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Profile: Shanghai Chemhere Co., Ltd. deals with lab reagent, fine chemicals and active pharmaceutical ingredients. We develop catalysts and key reagents for laboratories. Our chemicals are used in research institutes and universities. We also offer custom synthesis in both research and development scale.

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• 3,5-Dimethoxyphenylacetonitrile
IUPAC Name: 2-(3,5-dimethoxyphenyl)acetonitrile | CAS Registry Number: 13388-75-5
Synonyms: (3,5-Dimethoxyphenyl)acetonitrile, 3,4-Dimethoxyphenylacetonitrile, 591149_ALDRICH, NSC245126, CID139445, SBB005899, ZINC00400318, TL8000012, AA-504/07219022, 93-17-4

Molecular Formula: C10H11NO2Molecular Weight: 177.199840 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 3

InChIKey: UUNRWZQWCNTSCV-UHFFFAOYSA-N

• 1-(4-Bromophenyl)-2-pyrrolidinone
IUPAC Name: 1-(4-bromophenyl)pyrrolidin-2-one | CAS Registry Number: 7661-32-7
Synonyms: MLS000539454, ZINC00155729, 1-(4-bromophenyl)-2-pyrrolidinone, CID736110, SMR000125112, ST5307233

Molecular Formula: C10H10BrNOMolecular Weight: 240.096500 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 1

InChIKey: YINFEFUSAQRZGG-UHFFFAOYSA-N

• 2-(5-bromo-1h-indol-3-yl)ethanamine Hydrochloride
IUPAC Name: 2-(5-bromo-1H-indol-3-yl)ethanamine;hydrochloride | CAS Registry Number: 81868-12-4
Synonyms: 5-Bromotryptamine hydrochloride, 5-Bromotryptamine HCl, AGN-PC-00LNBW, SureCN687689, CTK8E5209, MolPort-003-889-429, AKOS015843645, AG-H-28305, CL18091, AK112228, AM807786, KB-73394, FT-0620179, B-9000, 1H-Indole-3-ethanamine, 5-bromo-, hydrochloride, 2-(5-Bromo-1H-indol-3-yl)ethanamine hydrochloride, I05-2821, 2-(5-Bromo-1H-indol-3-yl)-ethylamine hydrochloride, 3-(2-AMINOETHYL)-5-BROMOINDOLE HYDROCHLORIDE

Molecular Formula: C10H12BrClN2Molecular Weight: 275.572680 [g/mol]
H-Bond Donor: 3H-Bond Acceptor: 1

InChIKey: QUPXCOYSKSUJPX-UHFFFAOYSA-N

• 2,6-Dibromoaniline
IUPAC Name: 2,6-dibromoaniline | CAS Registry Number: 608-30-0
Synonyms: Aniline, 2,6-dibromo-, 2,6-dibromophenylamine, Benzenamine, 2,6-dibromo-, NSC305, D38804_ALDRICH, 33925_FLUKA, CID69098, EINECS 210-158-4, ZINC00388497, LT03333478, AE-641/00174064, InChI=1/C6H5Br2N/c7-4-2-1-3-5(8)6(4)9/h1-3H,9H

Molecular Formula: C6H5Br2NMolecular Weight: 250.918600 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 1

InChIKey: XIRRDAWDNHRRLB-UHFFFAOYSA-N

• 4-Chloro-alpha,alpha-dimethylphenylacetic acid
IUPAC Name: 2-(4-chlorophenyl)-2-methylpropanoic acid | CAS Registry Number: 6258-30-6
Synonyms: EINECS 228-392-0, SBB003559, 2-(p-Chlorophenyl)-2-methylpropionic acid, 2-(4-Chlorophenyl)-2-methylpropionic acid, 4-Chloro-.alpha.,.alpha.-dimethylphenylacetic acid

Molecular Formula: C10H11ClO2Molecular Weight: 198.646140 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 2

InChIKey: SSFDAZXGUKDEAH-UHFFFAOYSA-N

• 2-(1H-Indol-3-yl)ethan-1-ol
IUPAC Name: 2-(1H-indol-3-yl)ethanol | CAS Registry Number: 526-55-6
Synonyms: Tryptophol, Indole-3-ethanol, Indoleethanol, Indole ethanol, 3-Indolylethanol, 1H-Indole-3-ethanol, 3-Indoleethanol, 'Tryptophol', 3-(2-Hydroxyethyl)indole, 2-(3-Indolyl)ethanol, beta-Indol-3-ylethanol, (indol-3-yl)ethanol, Ethanol, 2-indol-3-yl-, 1H-Indolyl-3-ethanol, ETHANOL, 3-INDOLYL-, 2-(1H-Indol-3-yl)ethanol, 2-(indol-3-yl)ethanol, Maybridge1_002422, 3-(beta-Hydroxyethyl)indole, Indole-3-ethanol (8CI)

Molecular Formula: C10H11NOMolecular Weight: 161.200440 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 2

InChIKey: MBBOMCVGYCRMEA-UHFFFAOYSA-N

• 1-(2,4-Difluorophenyl)piperazine
IUPAC Name: 1-(2,4-difluorophenyl)piperazine | CAS Registry Number: 115761-79-0
Synonyms: 1-(2,4-Difluorophenyl)-piperazine, SBB016948

Molecular Formula: C10H12F2N2Molecular Weight: 198.212486 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 4

InChIKey: CMCSPBOWEYUGHB-UHFFFAOYSA-N

• 2-Amino-4-(2-aminophenyl)-4-oxobutanoic acid
IUPAC Name: (2S)-2-amino-4-(2-aminophenyl)-4-oxobutanoic acid | CAS Registry Number: 343-65-7
Synonyms: L-kynurenine, Kynurenine, L-, kynurenine, nchembio.125-comp7, 3-Anthraniloyl-L-alanine, bmse000172, beta-Anthraniloyl-L-alanine, CCRIS 4425, K8625_SIGMA, 3-(2-aminobenzoyl)-L-alanine, CHEBI:16946, CID161166, NCGC00163345-01, LS-29336, C00328, K-9020, L-2-Amino-4-(2-aminophenyl)-4-oxobutanoic acid, (2S)-2-amino-4-(2-aminophenyl)-4-oxobutanoic acid, 2922-83-0, KYN

Molecular Formula: C10H12N2O3Molecular Weight: 208.213880 [g/mol]
H-Bond Donor: 3H-Bond Acceptor: 5

InChIKey: YGPSJZOEDVAXAB-QMMMGPOBSA-N

• (R)-(+)-2-Benzyloxypropionic Acid
IUPAC Name: (2R)-2-phenylmethoxypropanoic acid | CAS Registry Number: 100836-85-9
Synonyms: O-Benzyl-D-lactic acid, (R)-(+)-2-(Benzyloxy)propionic acid, ST50408198, AC1OCSWM, SureCN138280, 00696_FLUKA, 58573_FLUKA, CTK3J6017, (2R)-2-phenylmethoxypropanoic acid, (2R)-2-(phenylmethoxy)propanoic acid, AKOS015894045, AG-D-06579, KB-80109, Propanoic acid,2-(phenylmethoxy)-,(2R)-, FT-0605091, I04-8477, Propanoicacid, 2-(phenylmethoxy)-, (R)-; (R)-(+)-O-Benzyllactic acid;R-2-Benzyloxypropionic acid

Molecular Formula: C10H12O3Molecular Weight: 180.200480 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 3

InChIKey: XWAVPOFYNPXXEL-MRVPVSSYSA-N

• 2',4'-Dimethoxyacetophenone
IUPAC Name: 1-(2,4-dimethoxyphenyl)ethanone | CAS Registry Number: 829-20-9
Synonyms: 2,4-Dimethoxyacetophenone, Resacetophenone dimethyl ether, D129402_ALDRICH, NSC46645, Acetophenone, 2',4'-dimethoxy-, Ethanone, 1-(2,4-dimethoxyphenyl)-, CID70016, EINECS 212-587-2, ZINC01678791, 1-(2,4-Dimethoxyphenyl)ethan-1-one, SDCCGMLS-0066943.P001, AI3-10505, ST5214359

Molecular Formula: C10H12O3Molecular Weight: 180.200480 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 3

InChIKey: VQTDPCRSXHFMOL-UHFFFAOYSA-N

• 1-(2,3-Dichlorophenyl)piperazine hydrochloride
IUPAC Name: 1-(2,3-dichlorophenyl)piperazine;hydrochloride | CAS Registry Number: 119532-26-2
Synonyms: 41202-77-1, 1-(2,3-Dichlorophenyl)piperazine monohydrochloride, SBB003054, 1-(2,3-Dichlorophenyl)-piperazine hydrochloride, 1-(2,3-dichlorophenyl)-piperazine monohydrochloride, (2,3-dichlorophenyl)piperazine, chloride, zlchem 392, PubChem8589, SureCN246338, AGN-PC-00D0JT, ACMC-209a34, 679135_ALDRICH, CTK0H4814, ZLC0238, MolPort-001-769-710, ACN-S002575, ACN-S002576, ACT02157, ANW-17342, FC0193

Molecular Formula: C10H13Cl3N2Molecular Weight: 267.582620 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 2

InChIKey: CYQFNNSFAGXCEC-UHFFFAOYSA-N

• (S)-(+)-2-Phenylbutyric Acid
IUPAC Name: (2S)-2-phenylbutanoic acid | CAS Registry Number: 4286-15-1
Synonyms: (S)-(+)-2-Phenylbutyric acid, (2s)-2-phenylbutanoic acid, (S)-2-Phenylbutanoic acid, PubChem9874, AC1LFXAE, AC1Q5QZQ, SureCN67237, AC1Q2C6Z, 279889_ALDRICH, AC1Q2C70, CTK4I6709, (S)-()-2-phenyl-Mutyric Acid, KST-1A8854, (S)-(+)-2-phenyl-Mutyric Acid, AR-1A3279, Benzeneacetic acid, a-ethyl-, (aS)-, AG-A-07800, KB-211229

Molecular Formula: C10H12O2Molecular Weight: 164.201080 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 2

InChIKey: OFJWFSNDPCAWDK-VIFPVBQESA-N

• 5-Methylbenzo[B]Thiophene-2-Methanol
IUPAC Name: (5-methyl-1-benzothiophen-2-yl)methanol | CAS Registry Number: 22962-49-8
Synonyms: (5-methyl-1-benzothiophen-2-yl)methanol, 5-Methylbenzo[b]thiophene-2-methanol, ZINC02563904, AC1MDRXI, SureCN122572, CTK4F0573, MolPort-000-145-235, SBB089454, AKOS006283726, AG-E-66441, MO07149, Benzo[b]thiophene-2-methanol,5-methyl-, AM803558, KB-43627, (5-Methyl-benzo[b]thiophen-2-yl)-methanol, (5-Methyl-benzo[b]thiophen-2-yl)-methanol;, (5-methylbenzo[b]thiophen-2-yl)methan-1-ol, A816448

Molecular Formula: C10H10OSMolecular Weight: 178.250800 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 2

InChIKey: NPSSZIBANMLQHP-UHFFFAOYSA-N

• 7-Aminocephalosporanic acid
IUPAC Name: (6R,7R)-3-(acetyloxymethyl)-7-amino-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid | CAS Registry Number: 957-68-6
Synonyms: Prestwick_714, 7-ACA, Prestwick0_000424, Prestwick1_000424, Prestwick2_000424, Prestwick3_000424, 7-Aminocephalosporinic acid, BSPBio_000408, Cephalosporanic acid, 7-amino, (7R)-7-Aminocephalosporanate, SPBio_002347, 191140_ALDRICH, BPBio1_000450, 07300_FLUKA, AIDS196416, AIDS-196416, SMP2_000203, NCGC00179570-01, C07756, 5-Thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid, 3-[(acetyloxy)methyl]-7-amino-8-oxo-, (6R,7R)-

Molecular Formula: C10H12N2O5SMolecular Weight: 272.277680 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 6

InChIKey: HSHGZXNAXBPPDL-HZGVNTEJSA-N

• (R)-2-Hydroxy-4-phenylbutyric acid
IUPAC Name: (2R)-2-hydroxy-4-phenylbutanoic acid | CAS Registry Number: 267013-77-4
Synonyms: 29678-81-7, (R)-(-)-2-Hydroxy-4-phenylbutyric acid, (2R)-2-hydroxy-4-phenylbutanoic acid, (R)-2-Hydroxy-4-phenylbutanoicAcid, (R)-2-hydroxy-4-phenylbutanoic acid, PubChem5687, SureCN233440, AC1MC05S, 420085_ALDRICH, AC1Q59Q5, Jsp005621, CTK4F8369, MolPort-001-794-060, ANW-26676, (r)-2-hydroxy-4-phenyl-butyric acid, AKOS015855449, AC-6643, R-(-)-2-Hydroxy-4-phenylbutyric acid, AK-34569, BR-34569

Molecular Formula: C10H12O3Molecular Weight: 180.200480 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 3

InChIKey: JNJCEALGCZSIGB-SECBINFHSA-N

• 2,4,6-Trimethylbenzonitrile
IUPAC Name: 2,4,6-trimethylbenzonitrile | CAS Registry Number: 2571-52-0
Synonyms: Mesitonitrile, .beta.-Isodurylonitrile, Benzonitrile, 2,4,6-trimethyl-, ZINC02146835, CID137649, FR-0627, BBV-2064567, S01-0500, InChI=1/C10H11N/c1-7-4-8(2)10(6-11)9(3)5-7/h4-5H,1-3H

Molecular Formula: C10H11NMolecular Weight: 145.201040 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 1

InChIKey: SNIZBGQMWRHNDY-UHFFFAOYSA-N

• 2-Phenoxyisobutyricacid
IUPAC Name: 2-(phenoxy)butanoic acid | CAS Registry Number: 13794-14-4
Synonyms: 2-Phenoxybutyric acid, alpha-Phenoxybutyric acid, DL-2-Phenoxybutyric acid, Butyric acid, 2-phenoxy-, Butanoic acid, 2-phenoxy-, .alpha.-Phenoxybutyric acid, ARONIS009903, EINECS 237-449-9, BRN 2048912, SBB000214, LS-48142, 3-06-00-00616 (Beilstein Handbook Reference)

Molecular Formula: C10H12O3Molecular Weight: 180.200480 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 3

InChIKey: TVSPPYGAFOVROT-UHFFFAOYSA-N

• 2,6-Dimethyl Phenoxy Acetic Acid
IUPAC Name: 2-(2,6-dimethylphenoxy)acetic acid | CAS Registry Number: 13335-71-2
Synonyms: 2,6-Dimethylphenoxy acetate, (2,6-Dimethylphenoxy)acetic acid, ARONIS004991, Acetic acid, (2,6-xylyloxy)-, CID101369, NSC408599, SBB015396, Acetic acid, (2,6-dimethylphenoxy)-, NSC 408599, (2,6-DIMETHYL-PHENOXY)-ACETIC ACID, Acetic acid, (2,6-xylyloxy)- (8CI), BAS 16434996, Acetic acid, (2,6-dimethylphenoxy)- (9CI), DBA

Molecular Formula: C10H12O3Molecular Weight: 180.200480 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 3

InChIKey: MLBCURLNKYKBEQ-UHFFFAOYSA-N

• 2,5-Dimethyl-4-anisaldehyde
IUPAC Name: 4-methoxy-2,5-dimethylbenzaldehyde | CAS Registry Number: 6745-75-1
Synonyms: 2,5-Dimethyl-p-anisaldehyde, 2,5-Dimethyl-para-anisaldehyde, 2,5-Dimethyl-4-methoxybenzaldehyde, 152056_ALDRICH, EINECS 229-807-8, ZINC00586270, ST5308487, InChI=1/C10H12O2/c1-7-5-10(12-3)8(2)4-9(7)6-11/h4-6H,1-3H

Molecular Formula: C10H12O2Molecular Weight: 164.201080 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 2

InChIKey: KYHULTSMPDXSLR-UHFFFAOYSA-N

• 1-Ethynyl-4-methoxy-2-methylbenzene
IUPAC Name: 1-ethynyl-4-methoxy-2-methylbenzene | CAS Registry Number: 74331-69-4
Synonyms: AG-G-95357, 521191_ALDRICH, CTK5D9711, 1-ethynyl-4-methoxy-2-methyl-benzene, AKOS010651629, Benzene,1-ethynyl-4-methoxy-2-methyl-, KB-12154, FT-0641510, A838094, I01-17211, 1-Ethynyl-4-methoxy-2-methylbenzene;4-Methoxy-2-methylphenylacetylene;

Molecular Formula: C10H10OMolecular Weight: 146.185800 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 1

InChIKey: IETBNYUYILAKFK-UHFFFAOYSA-N

• (S)-1,2,3,4-Tetrahydro-3-isoquinolinecarboxylic acid hydrochloride
IUPAC Name: (3S)-1,2,3,4-tetrahydroisoquinoline-3-carboxylic acid | CAS Registry Number: 74163-81-8
Synonyms: 421626_ALDRICH, 87437_FLUKA, AL081-1, ST5330564, L-1,2,3,4-Tetrahydroisoquinoline-3-carboxylic acid, (S)-1,2,3,4-Tetrahydro-3-isoquinolinecarboxylic acid

Molecular Formula: C10H11NO2Molecular Weight: 177.199840 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 3

InChIKey: BWKMGYQJPOAASG-VIFPVBQESA-N

• 2',5'-Dimethoxy acetophenone
IUPAC Name: 1-(2,5-dimethoxyphenyl)ethanone | CAS Registry Number: 1201-38-3
Synonyms: 2',5'-Dimethoxyacetophenone, 2,5-Dimethoxyacetophenone, Acetophenone, 2',5'-dimethoxy-, Ethanone, 1-(2,5-dimethoxyphenyl)-, D129607_ALDRICH, D2056_SIGMA, 2-Acetyl-1,4-dimethoxybenzene, NSC62094, CID70991, EINECS 214-858-0, NSC 62094, ZINC00164090, Acetophenone, 2',5'-dimethoxy- (8CI), ST5214448, InChI=1/C10H12O3/c1-7(11)9-6-8(12-2)4-5-10(9)13-3/h4-6H,1-3H

Molecular Formula: C10H12O3Molecular Weight: 180.200480 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 3

InChIKey: FAXUIYJKGGUCBO-UHFFFAOYSA-N

• 2,6-Dichloropurine riboside
IUPAC Name: (2R,3S,5R)-2-(2,6-dichloropurin-9-yl)-5-(hydroxymethyl)oxolane-3,4-diol | CAS Registry Number: 13276-52-3
Synonyms: 2,6-Dichloropurine-9-|A-D-riboside, 2,6-Dichloro-9-|A-D-ribofuranosyl-9H-purine

Molecular Formula: C10H10Cl2N4O4Molecular Weight: 321.116800 [g/mol]
H-Bond Donor: 3H-Bond Acceptor: 7

InChIKey: HJXWZGVMHDPCRS-DTUHVUQASA-N

• 2,4-Dihydro-5-(4-methylphenyl)-3H-pyrazol-3-one
IUPAC Name: 3-(4-methylphenyl)-1,4-dihydropyrazol-5-one | CAS Registry Number: 66076-78-6
Synonyms: 2,4-DIHYDRO-5-(4-METHYLPHENYL)-3H-PYRAZOL-3-ONE, AGN-PC-00KKZB, CTK5C3475, AKOS004121316, AG-G-48911, KB-164773, 3H-Pyrazol-3-one, 2,4-dihydro-5-(4-methylphenyl)-, 3H-Pyrazol-3-one,2,4-dihydro-5-(4-methylphenyl)-

Molecular Formula: C10H10N2OMolecular Weight: 174.199200 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 2

InChIKey: DDFWVWUTJUSDMK-UHFFFAOYSA-N

• 2-(2-Methylbenzamido)acetic acid
IUPAC Name: 2-[(2-methylbenzoyl)amino]acetic acid | CAS Registry Number: 42013-20-7
Synonyms: o-Toluric acid, 2-Methylhippuric acid, o-Methylhippuric acid, N-(o-Toluoyl)glycine, N-(2-Methylbenzoyl)glycine, N-(o-Toluoyl)-glycine, Oprea1_321487, Glycine, N-(2-methylbenzoyl)-, MLS001002411, 328006_ALDRICH, CID91637, EINECS 255-622-7, NSC163983, BBV-156774, NSC 163983, Glycine, N-(2-methylbenzoyl)- (9CI), SMR000368956, M-3778, InChI=1/C10H11NO3/c1-7-4-2-3-5-8(7)10(14)11-6-9(12)13/h2-5H,6H2,1H3,(H,11,14)(H,12,13

Molecular Formula: C10H11NO3Molecular Weight: 193.199240 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 3

InChIKey: YOEBAVRJHRCKRE-UHFFFAOYSA-N

• 3-[(4-fluorophenyl)thio]-2-hydroxy-2-methyl-propanoic Acid
IUPAC Name: 3-(4-fluorophenyl)sulfanyl-2-hydroxy-2-methylpropanoic acid | CAS Registry Number: 339530-91-5
Synonyms: 3-[(4-Fluorophenyl)thio]-2-hydroxy-2-methylpropanoic acid, 3-((4-fluorophenyl)thio)-2-hydroxy-2-methylpropanoic acid, 3-(4-Fluorophenylthio)-2-hydroxy-2-methylpropanoic acid, methylpropanoic acid, AGN-PC-00GRML, SureCN3811027, CTK4H1516, MolPort-005-938-060, ANW-58158, SBB063507, AKOS013796562, AG-F-15033, AC-19097, AK-87205, R789, 3-[(4-Fluorophenyl)thio]-2-hydroxy-2-, KB-178139, KB-180074, FT-0653403, M6303

Molecular Formula: C10H11FO3SMolecular Weight: 230.255943 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 5

InChIKey: CTYJERNWLVBMTF-UHFFFAOYSA-N

• 2,5-Dimethylphenylacetic acid
IUPAC Name: 2-(2,5-dimethylphenyl)acetic acid | CAS Registry Number: 13612-34-5
Synonyms: 2,5-Xylylacetic acid, (2,5-dimethylphenyl)acetic acid, EINECS 237-097-6, 2,5-DIMETHYLPHENYLACETIC ACID, ST5407852

Molecular Formula: C10H12O2Molecular Weight: 164.201080 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 2

InChIKey: RUSCTNYOPQOXDJ-UHFFFAOYSA-N

• 2,3-Dimethyl-5-nitroindole
IUPAC Name: 2,3-dimethyl-5-nitro-1H-indole | CAS Registry Number: 21296-94-6
Synonyms: Oprea1_859180, CBDivE_000081, 2,3-Dimethyl-5-nitro-1H-indole, ARONIS001280, NSC84204, CID88860, EINECS 244-321-6, NSC 84204, ZINC00184761, BAS 00547420, ST5233944, D-5470

Molecular Formula: C10H10N2O2Molecular Weight: 190.198600 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 3

InChIKey: LKIMRQIKTONPER-UHFFFAOYSA-N

• 4'-Dimethylaminophenyl acetylene
IUPAC Name: 4-ethynyl-N,N-dimethylaniline | CAS Registry Number: 17573-94-3
Synonyms: 4-ethynyl-N,N-dimethylbenzenamine, 4-Ethynyl-N,N-dimethylaniline, 1-Ethynyl-4-dimethylaniline, 4-Dimethylaminophenylacetylene, 752235-18-0, AC1NQ88Y, 592609_ALDRICH, CTK5J0608, MolPort-002-499-413, ANW-54657, SBB064833, ZINC02534480, AKOS010651568, AC-6444, AG-C-23409, AG-E-26157, AK-43705, AK101751, KB-38480, KB-72429

Molecular Formula: C10H11NMolecular Weight: 145.201040 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 1

InChIKey: ZWMAYLMVFSCMMS-UHFFFAOYSA-N

• [3-(2-Methylthiazol-4-Yl)phenyl]amine
IUPAC Name: 3-(2-methyl-1,3-thiazol-4-yl)aniline | CAS Registry Number: 89250-34-0
Synonyms: MLS000102882, Oprea1_237956, 642630_ALDRICH, IFLab1_003704, 2-Methyl-4-(3-aminophenyl)thiazole, 4-(3-Aminophenyl)-2-methylthiazole, CID736535, ZINC00158916, SDCCGMLS-0012324.P002, IDI1_009811, 3-(2-Methyl-thiazol-4-yl)-phenylamine, BAS 01377408, SMR000015712, EN300-11808

Molecular Formula: C10H10N2SMolecular Weight: 190.264800 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 2

InChIKey: CPHZPWZSSBCSAH-UHFFFAOYSA-N

• (S)-3-Amino-4-(3,4-dichlorophenyl)butanoic acid hydrochloride
IUPAC Name: (3S)-3-amino-4-(3,4-dichlorophenyl)butanoic acid;hydrochloride | CAS Registry Number: 270063-50-8
Synonyms: (S)-3-AMINO-4-(3,4-DICHLOROPHENYL)BUTANOIC ACID HYDROCHLORIDE, AC1MC5EP, (S)-3-Amino-4-(3,4-dichloro-phenyl)-butyric acid-HCl, CTK8E9385, MolPort-003-794-125, (3S)-3-amino-4-(3,4-dichlorophenyl)butanoic Acid Hydrochloride, AKOS015948737, AK114859, KB-211425, TL8002165, 3,4-Dichloro-L-beta-homophenylalanine hydrochloride, (S)-3-Amino-4-(3,4-dichloro-phenyl)butyric acid hydrochloride

Molecular Formula: C10H12Cl3NO2Molecular Weight: 284.566780 [g/mol]
H-Bond Donor: 3H-Bond Acceptor: 3

InChIKey: RNDGKTAEVJUWKK-FJXQXJEOSA-N

• (S)-3-Amino-4-(4-chlorophenyl)butanoic acid hydrochloride
IUPAC Name: (3S)-3-amino-4-(4-chlorophenyl)butanoic acid | CAS Registry Number: 270596-41-3
Synonyms: (S)-3-Amino-4-(4-chlorophenyl)butanoic acid, (S)-3-Amino-4-(4-chloro-phenyl)-butyric acid, SureCN288206, (3S)-3-amino-4-(4-chlorophenyl)butanoic Acid, AC1MC594, MolPort-003-986-697, AKOS016002866, AG-E-88059, AK-34464, KB-211434, TL8002182

Molecular Formula: C10H12ClNO2Molecular Weight: 213.660780 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 3

InChIKey: LCYHDQUYYVDIPY-VIFPVBQESA-N

• 3-(4-Methoxyphenyl)propionyl chloride
IUPAC Name: 3-(4-methoxyphenyl)propanoyl chloride | CAS Registry Number: 15893-42-2
Synonyms: 3-(4-methoxyphenyl)propanoyl chloride, ACMC-20anjm, AC1Q4CHD, 4-methoxy-chloropropiophenone;, Jsp003154, CTK0H4364, MolPort-001-792-803, ZINC02578899, AKOS009215874, AG-B-02672, 3-(4-methoxyphenyl)-propionyl chloride, L366, KB-178201, I14-41782, F2190-0137

Molecular Formula: C10H11ClO2Molecular Weight: 198.646140 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 2

InChIKey: FQVJPHCAWYRYCK-UHFFFAOYSA-N

• 3-(2-Chloro-Phenyl)-Pyrrolidine
IUPAC Name: 3-(2-chlorophenyl)pyrrolidine | CAS Registry Number: 885277-67-8
Synonyms: 3-(2-chlorophenyl)pyrrolidine, 3-(2-Chloro-phenyl)-pyrrolidine, AG-H-57437, AC1MY9IN, ACMC-1CMY0, Ambcb4006410, SureCN3651436, CTK3E6863, MolPort-002-053-755, ANW-39052, WTI-11485, AKOS009157507, AB25453, RP24282, 4-(2-CHLOROPHENYL)-PYRROLIDINE, AK-36720, KB-26541, PYRROLIDINE, 3-(2-CHLOROPHENYL)-, AM20041311, BB 0252260

Molecular Formula: C10H12ClNMolecular Weight: 181.661980 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 1

InChIKey: RCQFNQQYVSNBOJ-UHFFFAOYSA-N

• 8-Hydroxy-3,4-dihydronaphthalen-2(1H)-one
IUPAC Name: 8-hydroxy-3,4-dihydro-1H-naphthalen-2-one | CAS Registry Number: 53568-05-1
Synonyms: 8-Hydroxy-2-tetralone, 8-hydroxy-3,4-dihydro-1H-naphthalen-2-one, 8-Hydroxy-3,4-dihydro-2(1H)-naphthalenone, SBB056399, ZINC04288795, PubChem16050, 8-hydroxyl-2-tetralone, AC1LB7IG, SureCN264072, AC1Q6KR5, CTK4J8390, MolPort-001-765-971, ANW-60014, AR-1H4606, WTI-10065, AG-J-01241, KB-74251, 8-hydroxy-1,3,4-trihydronaphthalen-2-one, FT-0640175, 2(1H)-Naphthalenone,3,4-dihydro-8-hydroxy-

Molecular Formula: C10H10O2Molecular Weight: 162.185200 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 2

InChIKey: NDUSBJBOSIRESA-UHFFFAOYSA-N

• (S)-3-Amino-4-(4-fluorophenyl)butanoic acid hydrochloride
IUPAC Name: (3S)-3-amino-4-(4-fluorophenyl)butanoic acid;hydrochloride | CAS Registry Number: 270596-53-7
Synonyms: (S)-3-AMINO-4-(4-FLUOROPHENYL)BUTANOIC ACID HYDROCHLORIDE, AC1MC5A1, (s)-3-amino-4-(4-fluorophenyl)butyric acid hydrochloride, CTK8E9389, MolPort-003-794-047, (3S)-3-amino-4-(4-fluorophenyl)butanoic Acid Hydrochloride, SBB063979, AKOS015889867, AK114886, KB-211437, TL8002186, 4-Fluoro-L-beta-homophenylalanine hydrochloride, (S)-3-Amino-4-(4-fluoro-phenyl)-butyric acid-HCl

Molecular Formula: C10H13ClFNO2Molecular Weight: 233.667123 [g/mol]
H-Bond Donor: 3H-Bond Acceptor: 4

InChIKey: QCJJUEQWIMCTAA-FVGYRXGTSA-N

• 1,3,4,5-Tetrahydro-2H-1-Benzazepin-2-One
IUPAC Name: 1,3,4,5-tetrahydro-1-benzazepin-2-one | CAS Registry Number: 4424-80-0
Synonyms: NCIOpen2_000317, MLS000660452, NSC65882, ZINC04101101, 1,3,4,5-tetrahydro-2H-1-benzazepin-2-one, SMR000309971, Benzo[b]azepin-2-one, 1,3,4,5-tetrahydro-, AR-438/40240582, A3763/0159577

Molecular Formula: C10H11NOMolecular Weight: 161.200440 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 1

InChIKey: HRVRAYIYXRVAPR-UHFFFAOYSA-N

• (S)-(+)-Phenylsuccinic Acid
IUPAC Name: 2-phenylbutanedioic acid | CAS Registry Number: 4036-30-0
Synonyms: Phenylsuccinic acid, Phenylsuccinate, 2-Phenylsuccinate, 2-Phenylsuccinic acid, Succinic acid, phenyl-, Butanedioic acid, phenyl-, Phenyl-succinic acid, dl-Phenylsuccinic acid, 2-Phenyl-succinic acid, (S)-Phenylsuccinic acid, alpha-Phenylsuccinic acid, .alpha.-Phenylsuccinic acid, (+/-)-Phenylsuccinic acid, Butanedioic acid, 2-phenyl-, P35200_ALDRICH, Succinic acid, phenyl- (8CI), 78170_FLUKA, AKE-BBR-007409, (+)-PHENYL SUCCINIC ACID, CHEBI:225246

Molecular Formula: C10H10O4Molecular Weight: 194.184000 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 4

InChIKey: LVFFZQQWIZURIO-UHFFFAOYSA-N

• 4-Chloro-1-(4-hydroxyphenyl)-1-butanone
IUPAC Name: 4-chloro-1-(4-hydroxyphenyl)butan-1-one | CAS Registry Number: 7150-55-2
Synonyms: 4-Chloro-4'-hydroxybutyrophenone, NSC71882, EINECS 230-485-6, ZINC01697305, Butyrophenone, 4-chloro-4'-hydroxy-, ST5412062, 1-Butanone, 4-chloro-1-(4-hydroxyphenyl)-

Molecular Formula: C10H11ClO2Molecular Weight: 198.646140 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 2

InChIKey: HZCPODPQEZHXHM-UHFFFAOYSA-N

• 2-(2-Fluorophenyl)pyrrolidine hydrochloride
IUPAC Name: 2-(3-fluorophenyl)pyrrolidine | CAS Registry Number: 298690-72-9
Synonyms: 2-(3-fluorophenyl)pyrrolidine, 2-(3-fluorophenyl)-pyrrolidine, 2-(3-FLUORO-PHENYL)-PYRROLIDINE, AG-E-97508, ST084812, ZERO/004834, AC1Q4LJO, SureCN166716, Oprea1_820324, AC1N074F, 2-(3-Fluorophenyl)pyrrolidine;, CTK4G3949, CBI-BB ZERO/004834, MolPort-000-148-699, Pyrrolidine,2-(3-fluorophenyl)-, ACT01724, ANW-49386, BBL020487, SBB012996, STK347624

Molecular Formula: C10H12FNMolecular Weight: 165.207383 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 2

InChIKey: OADZVVBVXBBMPW-UHFFFAOYSA-N

• 4-(1h-Pyrazol-1-Yl)Benzylamine
IUPAC Name: (4-pyrazol-1-ylphenyl)methanamine | CAS Registry Number: 368870-03-5
Synonyms: 4-(1H-Pyrazol-1-yl)benzylamine, 1-[4-(1H-pyrazol-1-yl)phenyl]methanamine, 4-Pyrazol-1-yl-benzylamine, (4-pyrazol-1-ylphenyl)methanamine, [4-(pyrazol-1-yl)phenyl]methanamine, SBB021984, 1-[4-(Aminomethyl)phenyl]-1H-pyrazole, [4-(1H-pyrazol-1-yl)phenyl]methanamine, [4-(1H-Pyrazol-1-yl)phenyl]methylamine, (4-pyrazolylphenyl)methylamine, (4-(1H-PYRAZOL-1-YL)PHENYL)METHANAMINE, SDCCGMLS-0066006.P001, zlchem 1086, PubChem22753, SureCN45348, AC1MCR06, AC1Q53XT, AC1Q53XU, Oprea1_708203, CTK4H7344

Molecular Formula: C10H11N3Molecular Weight: 173.214440 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 2

InChIKey: AVKMXPDYQVKSFF-UHFFFAOYSA-N

• 2,4-Dichlorophenoxybutyric Acid
IUPAC Name: 4-(2,4-dichlorophenoxy)butanoic acid | CAS Registry Number: 94-82-6
Synonyms: Butoxone, Butyrac, Butormone, Buratal, Butirex, Butoxon, Legumex D, Butoxone amine, Butoxone ester, Butyrac ester, Embutox, Legumex, Butyrac 118, Butyrac 200, Embutox klean-up, Sys 67 Buratal, 2,4-D butyric acid, Caswell No. 316, 2,4-D Butyric, Spectrum_001855

Molecular Formula: C10H10Cl2O3Molecular Weight: 249.090600 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 3

InChIKey: YIVXMZJTEQBPQO-UHFFFAOYSA-N

• 6,7-Dimethoxy-4(1H)-quinazolinone
IUPAC Name: 6,7-dimethoxy-1H-quinazolin-4-one | CAS Registry Number: 13794-72-4
Synonyms: Maybridge3_001466, Oprea1_495367, ZINC00116236, SDCCGMLS-0065808.P001, IDI1_012853, TL8000871, 6,7-Dimethoxy-3,4-dihydroquinazoline-4-one, 10N-834

Molecular Formula: C10H10N2O3Molecular Weight: 206.198000 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 4

InChIKey: DMSRMHGCZUXCMJ-UHFFFAOYSA-N

• 4'5'-Dimethyl-2'-hydroxyacetophenone
IUPAC Name: 1-(2-hydroxy-4,5-dimethylphenyl)ethanone | CAS Registry Number: 36436-65-4
Synonyms: ZINC00938866, 2-Hydroxy-4,5-dimethylacetophenone, 2'-Hydroxy-4',5'-dimethylacetophenone, EINECS 253-035-0, CID118976, SBB016321

Molecular Formula: C10H12O2Molecular Weight: 164.201080 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 2

InChIKey: YXVSURZEXVMUAM-UHFFFAOYSA-N

• 2-Propylphenyl isocyanate
IUPAC Name: 1-isocyanato-2-propylbenzene | CAS Registry Number: 190774-57-3
Synonyms: 487449_ALDRICH, ZINC02568111, CID2733390

Molecular Formula: C10H11NOMolecular Weight: 161.200440 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 2

InChIKey: NSGTVMQTRFUUSL-UHFFFAOYSA-N

• 4-Methylhippuric Acid
IUPAC Name: 2-[(4-methylbenzoyl)amino]acetic acid | CAS Registry Number: 27115-50-0
Synonyms: p-Toluric acid, 4-Methylhippuric acid, p-Methylhippuric acid, N-(p-Toluoyl)glycine, N-(4-Methylbenzoyl)glycine, N-(p-Toluoyl)-glycine, Maybridge1_005796, Hippuric acid, p-methyl-, Oprea1_357822, DivK1c_002084, 328022_ALDRICH, Glycine, N-(4-methylbenzoyl)-, CHEBI:103973, Hippuric acid, p-methyl- (8CI), CID97479, EINECS 248-231-8, (4-Methyl-benzoylamino)-acetic acid, NSC126814, NSC 126814, CDS1_001044

Molecular Formula: C10H11NO3Molecular Weight: 193.199240 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 3

InChIKey: NRSCPTLHWVWLLH-UHFFFAOYSA-N

• 2'-Deoxyadenosine 5'- Monophosphate, Disodium Salt
IUPAC Name: [(2R,3S,5R)-5-(6-aminopurin-9-yl)-3-hydroxyoxolan-2-yl]methyl dihydrogen phosphate | CAS Registry Number: 2922-74-9
Synonyms: dAMP, Deoxyadenylic acid, Deoxy-AMP, Poly dAP, 2'-Deoxyadenylic acid, Oligo(dA), Poly(dA), 2'-Deoxy-AMP, d-AMP, 2'-dAMP, (dA)n, Deoxy-5'-adenylic acid, Deoxyadenosine monophosphate, Poly(deoxyadenylic acid), Polydeoxyriboadenylic acid, Deoxyadenosine 5'-phosphate, deoxyadenosine-phosphate, Deoxyadenylic acid polymer, 2'-Deoxyadenosine 5'-phosphate, PdA (VAN)

Molecular Formula: C10H14N5O6PMolecular Weight: 331.221821 [g/mol]
H-Bond Donor: 4H-Bond Acceptor: 11

InChIKey: KHWCHTKSEGGWEX-RRKCRQDMSA-N

• 2-Bromo-2-methylpropiophenone
IUPAC Name: 2-bromo-2-methyl-1-phenylpropan-1-one | CAS Registry Number: 10409-54-8
Synonyms: 2-Bromoisobutyrophenone, .alpha.-Bromoisobutyrophenone, alpha-Bromoisobutyrophenone, B69204_ALDRICH, Phenyl 2-bromo-2-propyl ketone, EINECS 233-879-6, ZINC00153526

Molecular Formula: C10H11BrOMolecular Weight: 227.097740 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 1

InChIKey: QMOSZSHTSOWPRX-UHFFFAOYSA-N

• 2-Bromo-4,5-dimethoxyphenylacetic acid
IUPAC Name: 2-(2-bromo-4,5-dimethoxyphenyl)acetic acid | CAS Registry Number: 4697-62-5
Synonyms: Oprea1_173201, MLS000111526, NSC143407, CID138324, SMR000107448, ST5408952

Molecular Formula: C10H11BrO4Molecular Weight: 275.095940 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 4

InChIKey: MDOLAGJKKZEHHW-UHFFFAOYSA-N

• 4-Phenylbutyryl chloride
IUPAC Name: 4-phenylbutanoyl chloride | CAS Registry Number: 18496-54-3
Synonyms: 4-phenylbutanoyl chloride, 4-Phenylbutanoylchloride, 4-PHENYLBUTYRYL CHLORIDE, 4-phenyl-butyryl chloride, SBB040702, AG-E-34388, ACMC-1CUIL, AC1Q3GAC, 4-phenyl-Mutanoyl Chloride, AGN-PC-00G7FI, CTK0H4452, MolPort-000-871-817, ZINC02569626, AKOS000268715, MCULE-6473558795, AK-39224, KB-40266, AM20030216, FT-0651679, A12536

Molecular Formula: C10H11ClOMolecular Weight: 182.646740 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 1

InChIKey: VQDQISMDUHBUFF-UHFFFAOYSA-N


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