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Profile: ChemSpecial supports pharmaceutical, biotech and agrochemical industries in their research, development and manufacture. Custom synthesis products and pharmaceutical intermediates forms our core business. We are also devoted to innovative chemical process technologies for the production of key pharmaceutical intermediates and active pharmaceutical ingredients.

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• 4-Hydroxypiperidine
IUPAC Name: piperidin-4-ol | CAS Registry Number: 5382-16-1
Synonyms: 4-Piperidinol, Piperidin-4-ol, 128775_ALDRICH, NSC62083, 56220_FLUKA, BB_SC-2766, CID79341, EINECS 226-373-1, NSC 62083, TL806407, AI3-39158

Molecular Formula: C5H11NOMolecular Weight: 101.146940 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 2

InChIKey: HDOWRFHMPULYOA-UHFFFAOYSA-N

• (R)-N-boc-3-Pyrrolidinol
IUPAC Name: tert-butyl (3R)-3-hydroxypyrrolidine-1-carboxylate | CAS Registry Number: 109431-87-0
Synonyms: (R)-1-N-Boc-3-hydroxypyrrolidine, (R)-1-Boc-3-hydroxypyrrolidine, (R)-(-)-N-Boc-3-pyrrolidinol, r-bochp, (r)-n-boc-3-pyrrolidinol, (R)-1-(tert-Butoxycarbonyl)-3-pyrrolidinol, (R)-1-N-Boc-3-hydroxy-pyrrolidine, (r)-n-(tert-butoxycarbonyl)-3-hydroxypyrrolidine, (r)-n-tboc-3-pyrrolidinol, (R)-1-Boc-3-pyrrolidinol, (r)-boc-3-hydroxypyrrolidine, (r)-3-hydroxypyrrolidine, n-boc protected, (R)-N-boc-3-hydropyrrolidine, (r)-(-)-boc-3-pyrrolidinol, boc-(r)-(-)-3-pyrrolidinol, (r)-n-boc-3-hydroxypyrrolidine, (R)-N-tert-Butoxycarbonyl-(-)-3-pyrrolidinol, n-t-boc-(r)-3-hydroxypyrrolidine, (R)-1-(tert-Butoxycarbonyl)-3-hydroxypyrrolidine, tert-butyl (3R)-3-hydroxypyrrolidine-1-carboxylate

Molecular Formula: C9H17NO3Molecular Weight: 187.236180 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 3

InChIKey: APCBTRDHCDOPNY-SSDOTTSWSA-N

• 1-N-Boc-4-methylenepiperidine
IUPAC Name: tert-butyl 4-methylidenepiperidine-1-carboxylate | CAS Registry Number: 159635-49-1
Synonyms: 1-Boc-4-methylene-piperidine, ZINC02382864, CID2756808, FS010917

Molecular Formula: C11H19NO2Molecular Weight: 197.274060 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 2

InChIKey: PDTZMULNKGUIEJ-UHFFFAOYSA-N

• (R)-1-Phenyl-3-propanolamine
IUPAC Name: (3R)-3-amino-3-phenylpropan-1-ol | CAS Registry Number: 170564-98-4
Synonyms: (R)-3-amino-3-phenylpropan-1-ol, (3R)-3-Amino-3-Phenylpropan-1-Ol, (r)-beta-phenylalaninol, (r)-1-phenyl-3-propanolamine, (R)-3-Amino-3-phenyl-1-propanol, AG-E-19772, (R)-A-Phenylalaninol, PubChem13853, AC1Q4UAY, SureCN1953317, (r)-3-phenyl-beta-alaninol, KSC491Q5L, CTK3J1855, R-3-amino-3-phenylpropan-1-ol, MolPort-002-501-546, (S)-2-amino-3-phenylpropan-1-ol, ACT04410, (r)-3-amino-3-phenyl propan-1-ol, (r)-3-amino-3-phenyl-propan-1-ol, AKOS005146368

Molecular Formula: C9H13NOMolecular Weight: 151.205620 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 2

InChIKey: SEQXIQNPMQTBGN-SECBINFHSA-N

• 5-Methoxy-2-methyl-3-indoleacetic acid
IUPAC Name: 2-(5-methoxy-2-methyl-1H-indol-3-yl)acetic acid | CAS Registry Number: 2882-15-7
Synonyms: 5 MIAA, Oprea1_768754, 105171_ALDRICH, 5-Methoxy-methylindoleacetic acid, 5-Methoxy-2-methyl indole acetic acid, NSC97026, EINECS 220-734-7, NSC 97026, SBB003362, 5-Methoxy-2-methylindol-3-ylacetic acid, M-3534

Molecular Formula: C12H13NO3Molecular Weight: 219.236520 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 4

InChIKey: TXWGINUZLBAKDF-UHFFFAOYSA-N

• (R)-1-Aminoindane
IUPAC Name: (1R)-2,3-dihydro-1H-inden-1-amine | CAS Registry Number: 10277-74-4
Synonyms: (R)-(-)-1-Aminoindan, (R)-(-)-1-Aminoindane, (1R)-2,3-dihydro-1H-inden-1-amine, (R)-(-)-1-Indanamine, (R)-2,3-dihydro-1H-inden-1-amine, (R)-1-Aminoindan, AC1MBZZT, PubChem21741, (1R)INDANYLAMINE, R-AI, SureCN42279, AC1Q4U9Q, RASAGILINE INTERMEDIATE, (R)-INDAN-1-YLAMINE, (1R)-INDAN-1-AMINE, (R)-(-)-INDANAMINE, 445347_ALDRICH, CTK0H4282, MolPort-001-767-521, ALPHACHIRON 19165A832

Molecular Formula: C9H11NMolecular Weight: 133.190340 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 1

InChIKey: XJEVHMGJSYVQBQ-SECBINFHSA-N

• (4R,6R)-t-Butyl-6-(2-aminoethyl)-2,2-dimethyl-1,3-dioxane-4-acetate
IUPAC Name: 2-[(4R,6R)-2,2-dimethyl-6-[2-[(2-methylpropan-2-yl)oxy]-2-oxoethyl]-1,3-dioxan-4-yl]ethylazanium | CAS Registry Number: 125995-13-3
Synonyms: ZINC04284042, CID7168028

Molecular Formula: C14H28NO4+Molecular Weight: 274.376420 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 4

InChIKey: HWSHVKNLMBMKSR-GHMZBOCLSA-O

• (1S,2R)-(-)-1Amino-2-indanol
IUPAC Name: [(1S,2R)-2-hydroxy-2,3-dihydro-1H-inden-1-yl]azanium | CAS Registry Number: 126456-43-7
Synonyms: ZINC00154811, ZINC00154815, CID10942615

Molecular Formula: C9H12NO+Molecular Weight: 150.197680 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 1

InChIKey: LOPKSXMQWBYUOI-BDAKNGLRSA-O

• (2E)-3-(2,5-Dimethoxyphenyl)-2-propenoic acid
IUPAC Name: (E)-3-(2,5-dimethoxyphenyl)prop-2-enoic acid | CAS Registry Number: 38489-74-6
Synonyms: 2,5-Dimethoxycinnamic acid, 2',5'-Dimethoxycinnamic acid, 143596_ALDRICH, MEGxp0_001746, ACon1_002358, trans-2,5-Dimethoxycinnamic acid, MolPort-000-652-916, MolPort-004-288-300, ALBB-007461, EINECS 234-114-9, CID697594, BBR-006853, NCGC00169921-01, (2E)-3-(2,5-dimethoxyphenyl)acrylic acid, 3-(2,5-Dimethoxyphenyl)-2-propenoic Acid, D1972, 2-Propenoic acid, 3-(2,5-dimethoxyphenyl)-, 2,5-Dimethoxycinnamic acid, predominantly trans, I01-3012, T5298808

Molecular Formula: C11H12O4Molecular Weight: 208.210580 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 4

InChIKey: JPQWWJZORKTMIZ-ZZXKWVIFSA-N

• (2E)-3-(1,3-Benzodioxol-5-yl)-2-propenoic acid
IUPAC Name: (E)-3-(1,3-benzodioxol-5-yl)prop-2-enoic acid | CAS Registry Number: 38489-76-8
Synonyms: 3,4-(METHYLENEDIOXY)CINNAMIC ACID, 3,4-Methylenedioxycinnamic acid, 3-(1,3-benzodioxol-5-yl)acrylic acid, 2373-80-0, 2-Propenoic acid, 3-(1,3-benzodioxol-5-yl)-, (2E)-3-(2H-1,3-benzodioxol-5-yl)prop-2-enoic acid, 2-Propenoic acid, 3-(1,3-benzodioxol-5-yl)-, (E)-, (2E)-3-(1,3-benzodioxol-5-yl)prop-2-enoic acid, 3,4-(Methylenedioxy)cinnamicacid, MDCA, piperonyl acrylic acid, PubChem8286, 3-(1,3-benzodioxol-5-yl)prop-2-enoic acid, 3-Piperonylacrylic Acid, AC1LD6NW, SureCN79427, Methylenedioxycinnamic acid, AC1Q5T9A, 146242_ALDRICH, Jsp004750

Molecular Formula: C10H8O4Molecular Weight: 192.168120 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 4

InChIKey: QFQYZMGOKIROEC-DUXPYHPUSA-N

• 3-Indole Acetic Acid
IUPAC Name: 2-(1H-indol-3-yl)acetic acid | CAS Registry Number: 87-51-4
Synonyms: indoleacetic acid, Heteroauxin, Rhizopin, 3-Indoleacetic acid, auxin, indole-3-acetic acid, indoleacetate, Hexteroauxin, Rhizopon A, 1H-Indole-3-acetic acid, indole-3-acetate, Acetic acid, indolyl-, 3-Iaa, beta-Indoleacetic acid, 3-(Carboxymethyl)indole, Heteroauxinhexteroauxiniaa, alpha-IAA, beta-Indolylacetic acid, Indol-3-ylacetic acid, beta-IAA

Molecular Formula: C10H9NO2Molecular Weight: 175.183960 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 3

InChIKey: SEOVTRFCIGRIMH-UHFFFAOYSA-N

• (R)-2-methylpyrrolidine hydrochloride
IUPAC Name: (2R)-2-methylpyrrolidine;hydrochloride | CAS Registry Number: 135324-85-5
Synonyms: (2R)-2-methylpyrrolidine Hydrochloride, (r)-2-methylpyrrolidine hcl, (R)-(-)-2-Methylpyrrolidine HCl, (R)-2-Methylpyrrolidinehydrochloride, (R)-2-Methyl-pyrrolidine hydrochloride, PubChem11117, SureCN238775, KSC495M9F, CTK3J5692, MolPort-002-499-366, ANW-52373, (R)-2-METHYL-PYRROLIDINE HCL, AKOS005146077, AKOS015844405, (r)-2-methyl pyrrolidine hydrochloride, AB29488, AC-6782, AG-A-07273, RP19442, (2R)-2-METHYLPYRROLIDINE, HCL

Molecular Formula: C5H12ClNMolecular Weight: 121.608480 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 1

InChIKey: JNEIFWYJFOEKIM-NUBCRITNSA-N

• (2S,3aR,7aS)-1H-Octahydroindole-2-carboxylic acid hydrochloride
IUPAC Name: (2S,3aR,7aS)-2,3,3a,4,5,6,7,7a-octahydro-1H-indole-2-carboxylic acid;hydrochloride | CAS Registry Number: 144540-75-0
Synonyms: (2S,3aR,7aS)-Octahydro-1H-indole-2-carboxylic acid hydrochloride, (2S,3aR,7aS)-1H-octahydroindole-2-carboxylic acid HCl, (2S,3aR,7aS)-Octahydro-indole-2-carboxylic acid hydrochloride, SureCN1041576, CTK8B6765, MolPort-003-987-526, ACN-S002175, ANW-54283, FD7233, SBB068338, AKOS015915339, AK-94020, Q728, KB-206590, TL8006163, I14-6262, [2S-(2a,3aa,7ab)]-1H-Indole-2-carboxylic acid, octahydro-, hydrochloride

Molecular Formula: C9H16ClNO2Molecular Weight: 205.681840 [g/mol]
H-Bond Donor: 3H-Bond Acceptor: 3

InChIKey: PONAUWFRJYNGAC-MWDCIYOWSA-N

• (R)-Methyl 3-Aminopentanoate Hydrochloride
IUPAC Name: methyl (3R)-3-aminopentanoate;hydrochloride | CAS Registry Number: 532435-35-1
Synonyms: (R)-Methyl 3-Aminopentanoate Hydrochloride Salt, PubChem23281

Molecular Formula: C6H14ClNO2Molecular Weight: 167.633860 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 3

InChIKey: QETMSSQMNUFHHA-NUBCRITNSA-N

• (R)-4-Bromostyrene Oxide
IUPAC Name: (2R)-2-(4-bromophenyl)oxirane | CAS Registry Number: 62566-68-1
Synonyms: (R)-4-Bromostyrene oxide, PubChem5705, CTK5B5315, (2R)-2-(4-bromophenyl)oxirane, (R)-2-(4-Bromo-phenyl)-oxirane, ZINC02383015, AKOS006288390, AG-G-29949, (-)-(R)-4-BROMOSTYRENE OXIDE, A833854, I01-9474

Molecular Formula: C8H7BrOMolecular Weight: 199.044580 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 1

InChIKey: NNINSLOEPXEZOZ-QMMMGPOBSA-N

• (r)-1-Boc-3-Phenylpyrrolidine
IUPAC Name: tert-butyl (3R)-3-phenylpyrrolidine-1-carboxylate | CAS Registry Number: 145549-11-7
Synonyms: (R)-1-Boc-3-Phenyl-pyrrolidine, (R)-1-Boc-3-Phenylpyrrolidine, AG-D-89528, (R)-3-PHENYL-PYRROLIDINE-1-CARBOXYLIC ACID TERT-BUTYL ESTER, PubChem19857, SureCN1751432, 1-Pyrrolidinecarboxylicacid, 3-phenyl-, 1,1-dimethylethyl ester, (3R)-, CTK4C4600, MolPort-019-878-434, ANW-54628, ZINC16697195, AKOS015841256, AKOS016001323, AB50105, AK-47865, KB-02749, (R)-TERT-BUTYL 3-PHENYLPYRROLIDINE-1-CARBOXYLATE, 1-Pyrrolidinecarboxylicacid, 3-phenyl-, 1,1-dimethylethyl ester, (R)-;

Molecular Formula: C15H21NO2Molecular Weight: 247.332740 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 2

InChIKey: REGWJCQNMMXFBM-ZDUSSCGKSA-N

• (r)-3-N-Bocaminomethylpyrrolidine
IUPAC Name: tert-butyl N-[[(3R)-pyrrolidin-3-yl]methyl]carbamate | CAS Registry Number: 173340-25-5
Synonyms: (r)-3-n-boc-aminomethylpyrrolidine, (r)-tert-butyl pyrrolidin-3-ylmethylcarbamate, (R)-3-N-Boc-aminomethyl pyrrolidine, tert-butyl (3R)-pyrrolidin-3-ylmethylcarbamate, (R)-tert-Butyl (pyrrolidin-3-ylmethyl)carbamate, tert-butyl N-[[(3R)-pyrrolidin-3-yl]methyl]carbamate, (r)-pyrrolidin-3-ylmethyl-carbamic acid tert-butyl ester, SureCN714892, AC1Q1N8Q, KSC869A6N, AC1LU349, CTK7G9066, (r)-3-boc-aminomethylpyrrolidine, MolPort-002-499-519, (r)-3-boc-aminomethyl-pyrrolidine, AKOS006239812, AKOS016015842, AG-B-52238, PB32480, RP25798

Molecular Formula: C10H20N2O2Molecular Weight: 200.278000 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 3

InChIKey: WIEJVMZWPIUWHO-MRVPVSSYSA-N

• (1-Aminocyclohexyl)-Aceticacidmethylester
IUPAC Name: methyl 2-(1-aminocyclohexyl)acetate | CAS Registry Number: 178242-64-3
Synonyms: Methyl 2-(1-aminocyclohexyl)acetate, (1-Amino-cyclohexyl)-acetic acid methyl ester, methyl (1-aminocyclohexyl)acetate, AG-E-28440, (1-Amino-cyclohexyl)-aceticacidmethylester, SureCN2311427, CTK4D6717, MolPort-002-499-497, ANW-54708, STL373326, AKOS006286648, AK-33772, EN001162, KB-00225, (1-Amino-cyclohexyl)acetic acid methyl ester, FT-0646960, Cyclohexaneacetic acid,1-amino-, methyl ester, I14-33242, Methyl 2-(1-aminocyclohexyl)acetate;Methyl (1-aminocyclohexyl)acetate;

Molecular Formula: C9H17NO2Molecular Weight: 171.236780 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 3

InChIKey: RLMHBOGYHKMLFN-UHFFFAOYSA-N

• (1r)-(s)-Pinanediol 1-Ammonium Trifluoroacetate-3-Methylbutane-1-Boronate
Synonyms: (R)-BoroLeu-(+)-Pinanediol-CF3COOH, (R)-BoroLeu-(+)-Pinanediol-CF3CO2H, (R)-BoroLeu-(+)-Pinanediol trifluoroacetate, PubChem11602, (aR,3aS,4S,6S,7aR)-Hexahydro-3a,8,8-trimethyl-alpha-(2-methylpropyl)-4,6-methano-1,3,2-benzodioxaborole-2-methanamine 2,2,2-trifluoroacetate, ACT03743, AKOS015896703, AC-2355, RL02289, AK-44948, (R)-BoroLeu-(+)-pinanediol-trifluoroacetate, I06-2263, (1R)-(S)-Pinanediol 1-ammonium trifluoroacetate-3-methylbutane-1-boronate, (1R)-(S)-Pinanediol-1-ammoniumtrifluoroacetate-3-methylbutane-1-boronate, (|AR)-(1S,2S,3R,5S)-Pinanediol-1-amino-3-methylbutane-1-boronate Trifluoroacetate, (|AR,3aS,4S,6S,7aR)-Hexahydro-3a,5,5-trimethyl-|A-(2-methylpropyl)-4,6-methano-1,3,2-benzodioxaborole-2-methanamine 2,2,2-Trifluoroacetate, (1R)-1-[(1S,2S,6R,8S)-1,8-dihydrogenio-2,9,9-trimethyl-3,5-dioxa-4-boratricyclo[6.1.1.02,6]decan-4-yl]-3-methylbutan-1-amine; trifluoroacetic acid, (1R)-3-methyl-1-[(1S,2S,6R,8S)-2,9,9-trimethyl-3,5-dioxa-4-boratricyclo[6.1.1.0?,?]decan-4-yl]butan-1-amine; trifluoroacetic acid, (R)-3-METHYL-1-((3AS,4S,6S,7AR)-3A,5,5-TRIMETHYLHEXAHYDRO-4,6-METHANOBENZO[D][1,3,2]DIOXABOROL-2-YL)BUTAN-1-AMINE 2,2,2-TRIFLUOROACETATE

Molecular Formula: C17H29BF3NO4Molecular Weight: 379.222670 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 8

InChIKey: SRFQKJZNJYTMNI-CDVUYJLHSA-N

• (r)-3-Aminobutyric Acid
IUPAC Name: (3R)-3-aminobutanoic acid | CAS Registry Number: 3775-73-3
Synonyms: (R)-3-AMINOBUTYRIC ACID, (R)-3-Amino-butyricacid, (3R)-3-aminobutanoic acid, D-A-Homoalanine, AmbotzHAA8430, AC1NWJCQ, R-3-Aminobutyric acid, (R)-beta-homo-alanine, (R)-3-Amino-butyric acid, (R)-HOMO-BETA-ALANINE, MolPort-008-268-111, ACT05190, Butanoic acid, 3-amino-, (3R)-, AKOS005146085, AKOS015995185, LS30206, RP18798, RP18802, AK-44656, BR-44656

Molecular Formula: C4H9NO2Molecular Weight: 103.119760 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 3

InChIKey: OQEBBZSWEGYTPG-GSVOUGTGSA-N

• (r)-1-Benzyl-3-N-Boc-Aminomethyl Pyrrolidine
IUPAC Name: tert-butyl N-[[(3R)-1-benzylpyrrolidin-3-yl]methyl]carbamate | CAS Registry Number: 852857-09-1
Synonyms: (R)-1-Benzyl-3-N-Boc-aminomethyl pyrrolidine, (r)-(1-benzyl-pyrrolidin-3-ylmethyl)-carbamic acid tert-butyl ester, AC1LTUYX, SureCN5450728, AB53986, (R)-1-Benzyl-3-N-Boc-aminomethylpyrrolidine, (R)-1-BENZYL-3-BOC-AMINOMETHYLPYRROLIDINE, tert-butyl N-[[(3R)-1-benzylpyrrolidin-3-yl]methyl]carbamate

Molecular Formula: C17H26N2O2Molecular Weight: 290.400540 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 3

InChIKey: MHRKPCRXBAHJGS-OAHLLOKOSA-N

• 4-[2-(piperazin-1-Yl)acetyl]morpholine
IUPAC Name: 1-morpholin-4-yl-2-piperazin-1-ylethanone | CAS Registry Number: 39890-46-5
Synonyms: NSC332546, 1-(Morpholinocarbonylmethyl)piperazine, BB_SC-3471, 4-(piperazin-1-ylacetyl)morpholine, ALBB-006141, EINECS 254-679-5, CID100622, STK500373, 4-(1-(1-Piperazine)acetyl)morpholine, 1-Morpholin-4-yl-2-piperazin-1-yl-ethanone, 1-(morpholin-4-yl)-2-(piperazin-1-yl)ethanone

Molecular Formula: C10H19N3O2Molecular Weight: 213.276760 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 4

InChIKey: LISKJKUMLVQGKE-UHFFFAOYSA-N

• 2-Methoxy-6,7,8,9-Tetrohydro-Benzocyclohepten-5-One
IUPAC Name: 2-methoxy-6,7,8,9-tetrahydrobenzo[7]annulen-5-one | CAS Registry Number: 6500-65-8
Synonyms: NSC105616, CID266815, ZINC04962369, 2-methoxy-6,7,8,9-tetrahydro-5H-benzo[a]cyclohepten-5-one

Molecular Formula: C12H14O2Molecular Weight: 190.238360 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 2

InChIKey: WLRMIOGKWITDNU-UHFFFAOYSA-N

• 1-[(1R)-Phenylethyl]piperazine
IUPAC Name: 1-[(1R)-1-phenylethyl]piperazine | CAS Registry Number: 773848-51-4
Synonyms: (R)-1-(1-PHENYL-ETHYL)-PIPERAZINE, AC1LFOPB, PubChem12286, SureCN3950480, 1-[(1R)-1-phenylethyl]piperazine, AKOS006323118, (R)-1-(1-PHENYLETHYL)PIPERAZINE, A9797, FT-0604321

Molecular Formula: C12H18N2Molecular Weight: 190.284720 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 2

InChIKey: PYBNQKSXWAIBKN-LLVKDONJSA-N

• 3-Chlorophenoxyacetic Acid
IUPAC Name: 2-(3-chlorophenoxy)acetic acid | CAS Registry Number: 588-32-9
Synonyms: m-Chlorophenoxyacetic acid, 3-CHLOROPHENOXYACETIC ACID, Acetic acid, (3-chlorophenoxy)-, (m-Chlorophenoxy)acetic acid, (3-chlorophenoxy)acetic acid, Acetic acid, (m-chlorophenoxy)-, HSDB 3943, AIDS017850, AIDS-017850, CID11497, NSC30115, EINECS 209-616-6, NSC 30115, STK326777, BBV-156923, Acetic acid, (m-chlorophenoxy)- (8CI), Acetic acid, (3-chlorophenoxy)- (9CI)

Molecular Formula: C8H7ClO3Molecular Weight: 186.592380 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 3

InChIKey: XSBUXVWJQVTYLC-UHFFFAOYSA-N

• (3s,4r)-(-)-4-(4'-Fluorophenyl)3-Hydroxymethyl)-Piperidine
IUPAC Name: [(3S,4R)-4-(4-fluorophenyl)piperidin-3-yl]methanol | CAS Registry Number: 125224-43-3
Synonyms: ((3S,4R)-4-(4-fluorophenyl)piperidin-3-yl)methanol, [(3S,4R)-4-(4-fluorophenyl)piperidin-3-yl]methanol, Racemic-[(3S,4R)-4-(4-fluorophenyl)piperidin-3-yl]methanol, (3S,4R)-(-)-(4-(4'-FLUOROPHENYL)3-HYDROXYMETHYL)-PIPERIDINE, (3S,4R)-[4-(4-Fluoro-phenyl)-piperidin-3-yl]-methanol, PubChem23483, trans-4-(4'-Fluorophenyl)3-hydroxymethyl)-piperidine, N-DESMETHYL PAROXOL, AC1Q77QW, SureCN4428153, PAROXETINE IMPURITY I, CTK7J7209, N-Desmethyl Paroxol Hydrochloride, MolPort-002-499-694, ACT02074, ANW-47972, SBB062844, AKOS015919686, AB16312, AG-A-04248

Molecular Formula: C12H16FNOMolecular Weight: 209.259943 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 3

InChIKey: IBOPBHBOBJYXTD-JQWIXIFHSA-N

• 5-Benzyloxyindole-3-acetic acid
IUPAC Name: 2-[5-(phenylmethoxy)-1H-indol-3-yl]acetic acid | CAS Registry Number: 4382-53-0
Synonyms: BOIAA, Oprea1_726357, B0626_SIGMA, CID96340, NSC68361, SBB003017, Indole-3-acetic acid, 5-(benzyloxy)-, 1H-Indole-3-acetic acid, 5-(phenylmethoxy)-, 2-(5-phenylmethoxy-1H-indol-3-yl)acetic acid, B-1750

Molecular Formula: C17H15NO3Molecular Weight: 281.305900 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 4

InChIKey: GKIOPUYLJUOZHJ-UHFFFAOYSA-N

• 2-Chloro-5-fluoropyrimidine
IUPAC Name: 2-chloro-5-fluoropyrimidine | CAS Registry Number: 62802-42-0
Synonyms: 5-Fluoro-2-chloropyrimidine, 2-Chloro-5-fluoro-pyrimidine, 651753_ALDRICH, FS001041, TL8004270, 3S211020

Molecular Formula: C4H2ClFN2Molecular Weight: 132.523483 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 3

InChIKey: AGYUQBNABXVWMS-UHFFFAOYSA-N

• (R)-4-Chloro-3-hydroxybutyronitrile
IUPAC Name: (3R)-4-chloro-3-hydroxybutanenitrile | CAS Registry Number: 84367-31-7
Synonyms: (R)-4-chloro-3-hydroxybutanenitrile, (R)-(+)-4-Chloro-3-hydroxybutyronitrile, Butanenitrile, 4-chloro-3-hydroxy-, ZINC02564699, PubChem6274, AC1LD22T, KSC497Q9J, 456152_ALDRICH, CTK3J7894, MolPort-003-933-459, ANW-46335, (3R)-4-chloro-3-hydroxybutanenitrile, AKOS015848710, AG-H-37005, AM81473, LS30057, AK-86343, K505, KB-03313, TL8005514

Molecular Formula: C4H6ClNOMolecular Weight: 119.549540 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 2

InChIKey: LHBPNZDUNCZWFL-SCSAIBSYSA-N

• 4-BMA
IUPAC Name: (2R)-2-[(2S,3S)-3-[(1R)-1-[tert-butyl(dimethyl)silyl]oxyethyl]-4-oxoazetidin-2-yl]propanoic acid | CAS Registry Number: 90776-58-2
Synonyms: 4-bma, side chain for imipenem, (3S,4S)-3-((R)-(tert-Butyldimethyl-silyloxy)ethyl)-4((R)-carboxyethyl)-2-azetidinone, (3S,4S)-3-[(R)-1-(tert-Butyldimethylsilyloxy)ethyl]-4-[(R)-1-carboxyethyl]-2-azetidinone, (3s,4s)-4-[(r)-1-carboxyethyl]-3-[(r)-1-(t-butyldimethylsilyloxy)ethyl]-2-azetidinone, (r)-2-((2s,3s)-3-((r)-1-(tert-butyldimethylsilyloxy)ethyl)-4-oxoazetidin-2-yl)propanoic acid, (r)-2-[(3s,4s)-3-[(r)-1-(tert-butyldimethylsilyloxy)ethyl]-2-oxoazetidin-4-yl]propionic acid, 4bma, SureCN2328228, CTK5G8408, (3S,4S)-4-[(R)-1-carboxy-ethyl]-3-[(R)-1-(t-butyldimethylsilyloxy)ethyl]-2-azetidinone, MolPort-003-987-419, ANW-39519, AKOS015836361, AKOS015950795, AC-4274, AG-L-25025, AK-94048, K799, AB1004615

Molecular Formula: C14H27NO4SiMolecular Weight: 301.453980 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 4

InChIKey: NNANGMFTFSNDLW-GWOFURMSSA-N

• (2s, 6r)-6-amino-2-(2-thienyl)-1,4-thiazepan
IUPAC Name: (2S,6R)-6-amino-2-thiophen-2-yl-1,4-thiazepan-5-one | CAS Registry Number: 110221-26-6
Synonyms: (2S,6R)-6-amino-2-(2-thienyl)-1,4-thiazepan-5-one, (2S,6R)-6-amino-2-(thiophen-2-yl)-1,4-thiazepan-5-one, 6-Amino-2-thiophen-2-yl-[1,4]thiazepan-5-one, (2S,6R)-6-Amino-5-oxo-2-(2-thienyl)perhydro-1,4-thiazepine, PubChem10603, CTK0H4443, MolPort-003-844-573, BH006, ACT08759, ANW-44825, FC0006, RW2421, SBB070594, SC3641, AKOS015918385, AC-4304, AG-D-27509, MB06253, AK-25290, KB-62739

Molecular Formula: C9H12N2OS2Molecular Weight: 228.334380 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 4

InChIKey: JIKPFDXBWSSTCF-XPUUQOCRSA-N

• (r )-1-benzyl-3-aminopiperidine
IUPAC Name: (3R)-1-(phenylmethyl)piperidin-3-amine | CAS Registry Number: 168466-84-0
Synonyms: 1-Benzyl-3-aminopiperidine, (R)-1-Benzyl-3-Aminopiperidine, CID854130, NSC137967, C-3101R, TL8001303

Molecular Formula: C12H18N2Molecular Weight: 190.284720 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 2

InChIKey: HARWNWOLWMTQCC-GFCCVEGCSA-N

• (3R)-3-aminopyrrolidine-3-carboxylic acid
IUPAC Name: (3R)-3-aminopyrrolidine-3-carboxylic acid | CAS Registry Number: 6807-92-7
Synonyms: Cucurbitine, CID442634, 3-Pyrrolidinecarboxylic acid, 3-amino-, (R)-, C10140

Molecular Formula: C5H10N2O2Molecular Weight: 130.145100 [g/mol]
H-Bond Donor: 3H-Bond Acceptor: 4

InChIKey: DWAKXSZUASEUHH-RXMQYKEDSA-N

• (R)-3,6-Diethoxy-2-isopropyl-2,5-dihydropyrazine
IUPAC Name: (2R)-3,6-diethoxy-2-propan-2-yl-2,5-dihydropyrazine | CAS Registry Number: 110117-71-0
Synonyms: (R)-2,5-Dihydro-3,6-diethoxy-2-isopropylpyrazine, (R)-3,6-diethoxy-2,5-dihydro-2-isopropylpyrazine, PubChem9908, AC1NRZJJ, SureCN2808933, Pyrazine,3,6-diethoxy-2,5-dihydro-2-(1-methylethyl)-, (2R)-, CTK4A6785, MolPort-003-984-022, ANW-52774, ZINC26893900, AKOS015838716, AKOS015900621, AG-D-27345, AK-32838, KB-209781, AM20090801, FT-0655426, ST51053850, (2R)-3,6-diethoxy-2-propan-2-yl-2,5-dihydropyrazine, Pyrazine, 3,6-diethoxy-2,5-dihydro-2-(1-methylethyl)-, (2R)-

Molecular Formula: C11H20N2O2Molecular Weight: 212.288700 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 4

InChIKey: HRAZLOIRFUQOPL-SNVBAGLBSA-N

• 4-Pentenoic acid, 2-amino-2-methyl-, (2S)-
IUPAC Name: (2S)-2-amino-2-methylpent-4-enoic acid | CAS Registry Number: 96886-55-4
Synonyms: (S)-2-Amino-2-Methyl-4-Pentenoic Acid, (S)-2-Amino-2-methylpent-4-enoic acid, (2S)-2-amino-2-methylpent-4-enoic acid, (R)-2-Amino-2-Methyl-4-Pentenoic Acid, AmbotzHAA5250, L-A-ALLYLALANINE, A-ALLYL-L-ALA, ALPHA-ALLYL-L-ALA, H-A-ALL-ALA-OH, L-ALPHA-ALLYLALANINE, (S)-A-ALLYLALANINE, AC1MC5L8, (S)-(-)-|A-Allylalanine, H-ALPHA-ALL-L-ALA-OH, CTK5H9000, MolPort-004-773-365, (S)-(-)-ALPHA-ALLYLALANINE, ANW-73300, (S)-ALPHA-METHYL-ALLYLGLYCINE, AKOS006342338

Molecular Formula: C6H11NO2Molecular Weight: 129.157040 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 3

InChIKey: QMBTZYHBJFPEJB-LURJTMIESA-N

• (1S,4R)-(-)-4-(Boc-amino)-2-cyclopentene-1-carboxylic acid
IUPAC Name: (1R,4R)-4-[(2-methylpropan-2-yl)oxycarbonylamino]cyclopent-2-ene-1-carboxylate | CAS Registry Number: 151907-79-8
Synonyms: ZINC02558244, ZINC04284300, CID7168125

Molecular Formula: C11H16NO4-Molecular Weight: 226.249040 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 4

InChIKey: WOUNTSATDZJBLP-YUMQZZPRSA-M

• 3,4,5-Trifluoropyridine
IUPAC Name: 3,4,5-trifluoropyridine | CAS Registry Number: 67815-54-7
Synonyms: 3,4,5-Trifluoropyridine;, SureCN1643631, Pyridine,3,4,5-trifluoro-, CTK5C6709, ZINC14983676, AKOS005063487, AG-G-57133, QC-7000, RP20038, KB-178854, FT-0649375, TL80073986, C-6166, I02-2549

Molecular Formula: C5H2F3NMolecular Weight: 133.071290 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 4

InChIKey: OCKWONYIDVFISR-UHFFFAOYSA-N

• (3-Bromopropoxy)-tert-butyldimethylsilane
IUPAC Name: 3-bromopropoxy-tert-butyl-dimethylsilane | CAS Registry Number: 89031-84-5
Synonyms: 3-bromopropoxy-tert-butyl-dimethylsilane, AC1LCVLD, ACMC-209unq, (3-Bromopropoxy)(tert-butyl)dimethylsilane, AC1Q1LK4, 429066_ALDRICH, CTK3J0508, MolPort-001-794-602, ACT10005, ANW-44004, AKOS015841201, AG-H-60677, (3-Bromopropoxy)-t-buyl-1-dimethylsilane, AK-44980, KB-01457, AB1007270, 3-bromanylpropoxy-tert-butyl-dimethyl-silane, FT-0650181, X7195, Propane, 1-bromo-3-(t-butyldimethylsilyloxy)-

Molecular Formula: C9H21BrOSiMolecular Weight: 253.251940 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 1

InChIKey: QGMROEZDWJTIDW-UHFFFAOYSA-N

• 2,3(1H)-Isoquinolinedicarboxylic acid, 3,4-dihydro-7-hydroxy-, 2-(1,1-dimethylethyl) ester, (3R)-
IUPAC Name: (3R)-7-hydroxy-2-[(2-methylpropan-2-yl)oxycarbonyl]-3,4-dihydro-1H-isoquinoline-3-carboxylic acid | CAS Registry Number: 214630-00-9
Synonyms: (R)-7-Hydroxy-2-Boc-3,4-dihydro-isoquinoline-3-carboxylic acid, (R)-2-(tert-Butoxycarbonyl)-7-hydroxy-1,2,3,4-tetrahydroisoquinoline-3-carboxylic acid, AmbotzBAA1462, SureCN6508024, BOC-7-HYDROXY-D-TIC-OH, CTK8C5114, ANW-74167, AK-80251, KB-63165, FT-0643976, Boc-D-7-hydroxy-1,2,3,4-tetrahydroisoquinoline-3-carboxylic Acid, (3R)-2-(tert-butoxycarbonyl)-7-hydroxy-3,4-dihydro-1H-isoquinoline-3-carboxylic acid, (R)-2-(tert-butoxycarbonyl)-1,2,3,4-tetrahydro-7-hydroxyisoquinoline-3-carboxylic acid, (R)-7-Hydroxy-3,4-dihydro-1H-isoquinoline-2,3-dicarboxylic acid 2-tert-butyl ester

Molecular Formula: C15H19NO5Molecular Weight: 293.315060 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 5

InChIKey: ZJYIVHWYSNWCSX-GFCCVEGCSA-N

• (R)-4-Benzyl-3-propionyl-2-oxazolidinone
IUPAC Name: (4R)-4-benzyl-3-propanoyl-1,3-oxazolidin-2-one | CAS Registry Number: 131685-53-5
Synonyms: (R)-(-)-4-Benzyl-3-propionyl-2-oxazolidinone, (R)-4-BENZYL-3-PROPIONYLOXAZOLIDIN-2-ONE, AG-D-64327, N-Propionyl-(4R)-Benzyl-2-Oxazolidinone, PubChem8128, SureCN237075, KSC497A5R, 459542_ALDRICH, CTK3J7058, MolPort-001-757-888, ACT01853, ANW-19372, ZINC00403114, AKOS015842713, OR14534, AC-18072, AK-47570, BR-47570, KB-63053, AB1007108

Molecular Formula: C13H15NO3Molecular Weight: 233.263100 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 3

InChIKey: WHOBYFHKONUTMW-LLVKDONJSA-N

• 6-Chloroindole
IUPAC Name: 6-chloro-1H-indole | CAS Registry Number: 17422-33-2
Synonyms: 6-Chloro-1H-indole, 1H-Indole, 6-chloro-, 246239_ALDRICH, NSC58083, ALBB-006051, CID87111, EINECS 241-449-4, SBB004059, ZINC00153934, C-4240

Molecular Formula: C8H6ClNMolecular Weight: 151.592940 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 1

InChIKey: YTYIMDRWPTUAHP-UHFFFAOYSA-N

• 5-Bromo-2-furaldehyde
IUPAC Name: 5-bromofuran-2-carbaldehyde | CAS Registry Number: 1899-24-7
Synonyms: 2-Furaldehyde, 5-bromo-, 433985_ALDRICH, 2-Furancarboxaldehyde, 5-bromo-, ALBB-004687, ZINC00155120, ST5124598, InChI=1/C5H3BrO2/c6-5-2-1-4(3-7)8-5/h1-3

Molecular Formula: C5H3BrO2Molecular Weight: 174.980120 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 2

InChIKey: WJTFHWXMITZNHS-UHFFFAOYSA-N

• 3-Benzyloxyphenylacetonitrile
IUPAC Name: 2-(3-phenylmethoxyphenyl)acetonitrile | CAS Registry Number: 20967-96-8
Synonyms: 3-(Phenylmethoxy)-benzenemethanol, 2-(3-phenylmethoxyphenyl)acetonitrile, ST092372, 2-(3-(benzyloxy)phenyl)acetonitrile, 2-[3-(benzyloxy)phenyl]acetonitrile, 2-[3-(phenylmethoxy)phenyl]ethanenitrile, ZINC00092902, Maybridge3_000453, AC1LAT65, AC1Q4S1C, SureCN1636426, Oprea1_182015, ACMC-20a415, 3-benzyloxy-phenyl acetonitrile, CTK3J3543, MolPort-001-768-604, HMS1432E13, ANW-56151, SBB071431, 2-(3-phenylmethoxyphenyl)ethanenitrile

Molecular Formula: C15H13NOMolecular Weight: 223.269820 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 2

InChIKey: CKZFVIPFANUBDW-UHFFFAOYSA-N

• (R)-(-)-2-Formylmandeloyl chloride
IUPAC Name: (2-chloro-2-oxo-1-phenylethyl) formate | CAS Registry Number: 29169-64-0
Synonyms: EINECS 249-478-4, (R)-alpha-(Formyloxy)benzeneacetyl chloride

Molecular Formula: C9H7ClO3Molecular Weight: 198.603080 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 3

InChIKey: ZNLABNPTWSKGDX-UHFFFAOYSA-N

• 3-(Trifluoromethyl)mandelic acid
IUPAC Name: 2-hydroxy-2-[3-(trifluoromethyl)phenyl]acetic acid | CAS Registry Number: 349-10-0
Synonyms: EINECS 206-484-1, DL-2-(3-Trifluoromethyl)phenylglycollic acid

Molecular Formula: C9H7F3O3Molecular Weight: 220.145290 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 6

InChIKey: WECBNRQPNXNRSJ-UHFFFAOYSA-N

• 5-Fluoro-2-methoxypyridine
IUPAC Name: 5-fluoro-2-methoxypyridine | CAS Registry Number: 51173-04-7
Synonyms: 5-fluoro-2-methoxypyridine, 2-Methoxy-5-fluoropyridine, 5-Fluoro-2-methoxy-pyridine, AG-F-72855, PYRIDINE, 5-FLUORO-2-METHOXY-, ZINC02384083, PubChem11248, AC1MD3XK, ACMC-1B1GH, 3-Fluoro-6-methoxypyridine, SureCN1736269, 5-fluoro-2-methoxy pyridine, 5-Fluoro-2-methoxypyridine;, KSC497O4B, CTK3J7740, MolPort-001-772-562, 5-Fluoropyridin-2-yl methyl ether, ABBYPHARMA AP-14-5659, ACN-S004504, ACT01473

Molecular Formula: C6H6FNOMolecular Weight: 127.116343 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 3

InChIKey: GYGABXVZIHADCT-UHFFFAOYSA-N

• 2-Methoxy-4-chlorobenzoic acid
IUPAC Name: 4-chloro-2-methoxybenzoic acid | CAS Registry Number: 57479-70-6
Synonyms: 4-Chloro-o-anisic acid, 4-Chloro-ortho-anisic acid, 145793_ALDRICH, 4-Chloro-2-methoxybenzoic acid, Benzoic acid, 4-chloro-2-methoxy-, EINECS 260-761-1, AI3-34239, ST5406575, InChI=1/C8H7ClO3/c1-12-7-4-5(9)2-3-6(7)8(10)11/h2-4H,1H3,(H,10,11

Molecular Formula: C8H7ClO3Molecular Weight: 186.592380 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 3

InChIKey: UFEYMXHWIHFRBX-UHFFFAOYSA-N

• 2-Isopropylphebylboronic acid
IUPAC Name: (2-propan-2-ylphenyl)boronic acid | CAS Registry Number: 89787-12-2
Synonyms: 2-Isopropylphenylboronic acid, I3920G1, ST5408506, TL8005785

Molecular Formula: C9H13BO2Molecular Weight: 164.009320 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 2

InChIKey: KTZUVUWIBZMHMC-UHFFFAOYSA-N

• 1-Piperidinecarboxylic acid, 2-(aminomethyl)-, 1,1-dimethylethyl ester, (2R)-
IUPAC Name: tert-butyl (2R)-2-(aminomethyl)piperidine-1-carboxylate | CAS Registry Number: 683233-14-9
Synonyms: (r)-2-aminomethyl-n-boc-piperidine, (R)-2-(Aminomethyl)-1-N-Boc-piperidine, (R)-2-Aminomethyl-1-N-Boc-piperidine, (R)-tert-butyl 2-(aminomethyl)piperidine-1-carboxylate, AG-G-62149, (r)-2-aminomethyl-piperidine-1-carboxylic acid tert-butyl ester, 1-piperidinecarboxylic acid, 2-(aminomethyl)-, 1,1-dimethylethyl ester, (2r)-, AC1LT3YF, SureCN80021, CTK5C7805, MolPort-000-140-279, ANW-45310, AKOS005258698, AB25907, RP26833, AK-27267, BR-27267, KB-63160, AB1006543, (R)-2-AMINOMETHYL-1-BOC-PIPERIDINE

Molecular Formula: C11H22N2O2Molecular Weight: 214.304580 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 3

InChIKey: PTVRCUVHYMGECC-SECBINFHSA-N

• 1-Piperidinecarboxylic acid, 2-cyano-, 1,1-dimethylethyl ester, (2R)-
IUPAC Name: tert-butyl (2R)-2-cyanopiperidine-1-carboxylate | CAS Registry Number: 940000-26-0
Synonyms: (R)-1-N-Boc-2-cyano-piperidine, (r)-tert-butyl 2-cyanopiperidine-1-carboxylate, (r)-n-boc-2-cyanopiperidine, PubChem11470, SureCN82202, (r)-1-n-boc-2-cyanopiperidine, CTK5H4502, 1-n-boc-2-(r)-cyano-piperidine, ZINC02385976, AKOS007930629, AG-H-86041, AK-45041, (r)-tert-butyl-2-cyanopiperidine-1-carboxylate, A12697, B-1351, B66752, TERT-BUTYL (2R)-2-CYANOPIPERIDINECARBOXYLATE, (R)-2-Cyano-piperidine-1-carboxylic acid tert-butyl ester, 1-piperidinecarboxylic acid, 2-cyano-, 1,1-dimethylethyl ester, (2r)-

Molecular Formula: C11H18N2O2Molecular Weight: 210.272820 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 3

InChIKey: LKAJZBMOVZIKHA-SECBINFHSA-N


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