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• 1-Amino 4-Methyl Piperazine
IUPAC Name: 4-methylpiperazin-1-amine | CAS Registry Number: 6928-85-4
Synonyms: 1-Amino-4-methylpiperazine, 1-Piperazinamine, 4-methyl-, 4-Methylpiperazin-1-amine, A65131_ALDRICH, 255688_ALDRICH, NSC80649, CID81349, EINECS 230-053-7, NSC 80649, SBB004299, 1-Amino-4-methylpiperazine dihydrochloride monohydrate

Molecular Formula: C5H13N3Molecular Weight: 115.176820 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 3

InChIKey: RJWLLQWLBMJCFD-UHFFFAOYSA-N

• 2,3 Dichlorophenol
IUPAC Name: 2,3-dichlorophenol | CAS Registry Number: 576-24-9
Synonyms: 2,3-DICHLOROPHENOL, Phenol, 2,3-dichloro-, Phenol, dichloro-, DICHLOROPHENOL, Dichlorophenols, solid, Dichlorophenols, liquid, Ambap5765, CCRIS 5902, D69807_ALDRICH, HSDB 4264, 442291U_SUPELCO, EINECS 209-399-8, NSC 60646, NSC60646, BRN 2043615, EINECS 246-693-5, ZINC00388511, LS-1403, NCGC00091161-01, AI3-15332

Molecular Formula: C6H4Cl2OMolecular Weight: 163.001360 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 1

InChIKey: UMPSXRYVXUPCOS-UHFFFAOYSA-N

• 2,3-Dichloro Benzoic Acid
IUPAC Name: 2,3-dichlorobenzoic acid | CAS Registry Number: 50-45-3
Synonyms: 2,3-DICHLOROBENZOIC ACID, Benzoic acid, 2,3-dichloro-, 225339_ALDRICH, 34329_RIEDEL, EINECS 200-039-5, BRN 1946217, SBB003641, AI3-33364, FR-2156, LS-1305, NCGC00091187-01, TL8003347, 4-09-00-00998 (Beilstein Handbook Reference), InChI=1/C7H4Cl2O2/c8-5-3-1-2-4(6(5)9)7(10)11/h1-3H,(H,10,11

Molecular Formula: C7H4Cl2O2Molecular Weight: 191.011460 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 2

InChIKey: QAOJBHRZQQDFHA-UHFFFAOYSA-N

• 2,4-Diamino-6-hydroxypyrimidine
IUPAC Name: 2,6-diamino-1H-pyrimidin-4-one | CAS Registry Number: 56-06-4
Synonyms: 2,6-Diamino-4-pyrimidinol, 2,4-Diaminohypoxanthine, Tocris-0476, 2,6-Diamino-4-pyrimidinone, 2,6-Diamino-4-hydroxypyrimidine, 4(1H)-Pyrimidinone, 2,6-diamino-, Lopac-D1920-6, 2,6-diaminopyrimidin-4-ol, Lopac0_000419, C4H6N4O, D19206_ALDRICH, MLS002153230, NSC9302, 2,4-DAHP, 2,6-Diamino-1H-pyrimidin-4-one, DHAP-2,4, NSC 9302, 33050_FLUKA, EINECS 200-254-4, NSC 44914

Molecular Formula: C4H6N4OMolecular Weight: 126.116640 [g/mol]
H-Bond Donor: 3H-Bond Acceptor: 4

InChIKey: SWELIMKTDYHAOY-UHFFFAOYSA-N

• 2,4-Difluoroaniline
IUPAC Name: 2,4-difluoroaniline | CAS Registry Number: 367-25-9
Synonyms: 2,4-DIFLUOROANILINE, 2,4-Difluroaniline, Benzenamine, 2,4-difluoro-, Aniline, 2,4-difluoro-, 2,4-Difluorobenzenamine, CCRIS 4621, D101400_ALDRICH, 36870_FLUKA, EINECS 206-687-5, NSC 10297, LS-97, NSC10297, BRN 2802556, ZINC00157573, AI3-52650, SDCCGMLS-0066219.P001, NCGC00091684-01, SB 00555, TL8002710, 4-12-00-01112 (Beilstein Handbook Reference)

Molecular Formula: C6H5F2NMolecular Weight: 129.107406 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 3

InChIKey: CEPCPXLLFXPZGW-UHFFFAOYSA-N

• 2,4-Dinitroaniline
IUPAC Name: 2,4-dinitroaniline | CAS Registry Number: 97-02-9
Synonyms: 2,4-DINITROANILINE, Aniline, 2,4-dinitro-, 2,4-Dinitraniline, Benzenamine, 2,4-dinitro-, 2,4-Dinitroanilin, 2,4-Dinitroanilina, 2,4-Dinitrobenzenamine, 2,4-Dinitrophenylamine, 1-Amino-2,4-dinitrobenzene, WLN: WNR BZ ENW, 2,4-Dinitroanilin [German], 2,4-Dinitroanilina [Italian], CCRIS 2872, ghl.PD_Mitscher_leg0.930, HSDB 1142, D193011_ALDRICH, 45963_RIEDEL, NCI-C60753, NSC 8731, EINECS 202-553-5

Molecular Formula: C6H5N3O4Molecular Weight: 183.121600 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 5

InChIKey: LXQOQPGNCGEELI-UHFFFAOYSA-N

• 2,5 Dichlorophenol
IUPAC Name: 2,5-dichlorophenol | CAS Registry Number: 583-78-8
Synonyms: 2,5-dichlorophenol, Phenol, 2,5-dichloro-, 3,6-dichlorophenol, Ambap5772, 2,5-DCP, 25-DICHLOROPHENOL, CCRIS 5903, D70007_ALDRICH, HSDB 4287, 35835_RIEDEL, 442320_SUPELCO, NSC 6296, 36140_FLUKA, CHEBI:27929, EINECS 209-520-4, NSC6296, BRN 1907692, c0545, ZINC00388512, LS-1409

Molecular Formula: C6H4Cl2OMolecular Weight: 163.001360 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 1

InChIKey: RANCECPPZPIPNO-UHFFFAOYSA-N

• 2,5-Dichlorothiophene
IUPAC Name: 2,5-dichlorothiophene | CAS Registry Number: 3172-52-9
Synonyms: 2,5-DICHLOROTHIOPHENE, 2,-Dichlorothiophene, Thiophene, 2,5-dichloro-, D75807_ALDRICH, AIDS018336, AIDS-018336, NSC60527, EINECS 221-638-8, NSC 60527, ZINC01690277, SB 00617, TL8002424, InChI=1/C4H2Cl2S/c5-3-1-2-4(6)7-3/h1-2

Molecular Formula: C4H2Cl2SMolecular Weight: 153.029680 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 0

InChIKey: FGYBDASKYMSNCX-UHFFFAOYSA-N

• 2,5-Diethoxyaniline
IUPAC Name: 2,5-diethoxyaniline | CAS Registry Number: 94-85-9
Synonyms: 2,5-Diethoxy aniline, Aniline, 2,5-diethoxy-, Benzenamine, 2,5-diethoxy-, Aminohydroquinone diethyl ether, 524220_ALDRICH, NSC7486, Aniline, 2,5-diethoxy- (8CI), NSC 7486, EINECS 202-369-5, ZINC00157614, AI3-16638, ST5405881, InChI=1/C10H15NO2/c1-3-12-8-5-6-10(13-4-2)9(11)7-8/h5-7H,3-4,11H2,1-2H

Molecular Formula: C10H15NO2Molecular Weight: 181.231600 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 3

InChIKey: XPKFTIYOZUJAGA-UHFFFAOYSA-N

• 2,5-Dihydroxyacetophenone
IUPAC Name: 1-(2,5-dihydroxyphenyl)ethanone | CAS Registry Number: 490-78-8
Synonyms: Quinacetophenone, 2-Acetylhydroquinone, Acetylhydroquinone, Acetylquinol, Acetophenone, 2',5'-dihydroxy-, 2',5'-DIHYDROXYACETOPHENONE, Ethanone, 1-(2,5-dihydroxyphenyl)-, WLN: QR CQ BV1, 1-(2,5-Dihydroxyphenyl)ethanone, ghl.PD_Mitscher_leg0.355, D107603_ALDRICH, 2-Acetyl-1,4-dihydroxybenzene, NSC 3759, 89415_FLUKA, EINECS 207-716-4, NSC3759, 2,5-Dihydroxyphenyl methyl ketone, BRN 0637903, ZINC00164902, AI3-18221

Molecular Formula: C8H8O3Molecular Weight: 152.147320 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 3

InChIKey: WLDWSGZHNBANIO-UHFFFAOYSA-N

• 2,5-Di-tert-butylhydroquinone
IUPAC Name: 2,5-ditert-butylbenzene-1,4-diol | CAS Registry Number: 88-58-4
Synonyms: Dibug, Dybug, Santovar O, Nonflex Alba, Antage DBH, DTBHQ, 2agv, Nocrac NS 7, tBuBHQ, Naugard 451, Di-t-butylhydroquinone, t-BuBHQ, 2,5-Di-tert-butylquinol, Tocris-1236, 2,5-di-t-butylquinol, 2,5-Di-t-butylhydroquinone, CCRIS 5218, NSC 11, NSC11, Oprea1_534698

Molecular Formula: C14H22O2Molecular Weight: 222.323280 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 2

InChIKey: JZODKRWQWUWGCD-UHFFFAOYSA-N

• 2-Chloro-6-nitrotoluene
IUPAC Name: 1-chloro-2-methyl-3-nitrobenzene | CAS Registry Number: 83-42-1
Synonyms: Caswell No. 202, 6-Chloro-2-nitrotoluene, Toluene, 2-chloro-6-nitro-, Ambap311, 2-CHLORO-6-NITROTOLUENE, 3-Chloro-2-methylnitrobenzene, Benzene, 1-chloro-2-methyl-3-nitro-, 1-Chloro-2-methyl-3-nitrobenzene, 101699_ALDRICH, 25630_FLUKA, EINECS 201-475-9, NSC 49147, EPA Pesticide Chemical Code 019001, NSC49147, BRN 1239924, ZINC01681234, AI3-00485, LS-154035, ST5406247, 4-05-00-00854 (Beilstein Handbook Reference)

Molecular Formula: C7H6ClNO2Molecular Weight: 171.581040 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 2

InChIKey: XCSNRORTQRKCHB-UHFFFAOYSA-N

• 5-Methoxylindole
IUPAC Name: 5-methoxy-1H-indole | CAS Registry Number: 1006-94-6
Synonyms: Femedol, 5-Methoxy-1H-indole, 5-METHOXYINDOLE, Indole, 5-methoxy-, 1H-Indole, 5-methoxy-, Methoxy-5 indole, Indol-5-yl methyl ether, Methoxy-5 indole [French], M14900_ALDRICH, 1H-Indol-5-yl methyl ether, Methoxy-5 indole [French], WLN: T56 BMJ GO1, EINECS 213-745-3, 1H-Indole, 5-methoxy- (9CI), NSC 521752, CID13872, NSC521752, SBB004094, ZINC00158156, M2323G1

Molecular Formula: C9H9NOMolecular Weight: 147.173860 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 2

InChIKey: DWAQDRSOVMLGRQ-UHFFFAOYSA-N

• 2-Chloroacrylonitrile
IUPAC Name: 2-chloroprop-2-enenitrile | CAS Registry Number: 920-37-6
Synonyms: Chloroacrylonitrile, Acrylonitrile, 2-chloro-, 2-Propenenitrile, 2-chloro-, 2-Chloro-2-propenenitrile, WLN: NCYGU1, .alpha.-Chloroacrylonitrile, CCRIS 6869, C22369_ALDRICH, 2-CHLORO-2-PROPENITRILE, EINECS 213-055-2, NSC 511714, CID70198, BRN 0773744, NSC511714, ZINC01603500, LS-14754, InChI=1/C3H2ClN/c1-3(4)2-5/h1H, 4-02-00-01484 (Beilstein Handbook Reference)

Molecular Formula: C3H2ClNMolecular Weight: 87.507680 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 1

InChIKey: OYUNTGBISCIYPW-UHFFFAOYSA-N

• 2-Chloro-Propionic Acid
IUPAC Name: 2-chloropropanoic acid | CAS Registry Number: 598-78-7
Synonyms: 2-Chloropropionic acid, Propanoic acid, 2-chloro-, Propionic acid, 2-chloro-, 2-CHLOROPROPANOIC ACID, Chloropropanoic acid, Chloropropionic acid, alpha-Chloropropionic acid, Monochloropropionic acid, 2-chloro-propanoic acid, Propanoic acid, chloro-, Propionic acid, chloro-, D-2-Chloropropionic acid, R-2-Chloropropionic acid, alpha-Monochloropropionic acid, WLN: QVYG1, Propionic acid, alpha-chloro-, ()-2-Chloropropionic acid, NCIOpen2_009382, .alpha.-Chloropropionic acid, HSDB 5713

Molecular Formula: C3H5ClO2Molecular Weight: 108.523600 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 2

InChIKey: GAWAYYRQGQZKCR-UHFFFAOYSA-N

• 2-Fluorotoluene
IUPAC Name: 1-fluoro-2-methylbenzene | CAS Registry Number: 95-52-3
Synonyms: Toluene, o-fluoro-, O-FLUOROTOLUENE, 1-Fluoro-2-methylbenzene, Benzene, 1-fluoro-2-methyl-, 1-Methyl-2-fluorobenzene, Ambap7191, F15323_ALDRICH, NSC 8859, EINECS 202-428-5, CID7241, NSC8859, UN2388, BRN 1853362, LS-154075, o-Fluorotoluene [UN2388] [Flammable liquid], o-Fluorotoluene [UN2388] [Flammable liquid], 4-05-00-00799 (Beilstein Handbook Reference), InChI=1/C7H7F/c1-6-4-2-3-5-7(6)8/h2-5H,1H

Molecular Formula: C7H7FMolecular Weight: 110.128883 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 1

InChIKey: MMZYCBHLNZVROM-UHFFFAOYSA-N

• 2'-Hydroxy-3-Phenylpropiophenone
IUPAC Name: 1-(2-hydroxyphenyl)-3-phenylpropan-1-one | CAS Registry Number: 3516-95-8
Synonyms: 2'-Hydroxy-3-phenylpropiophenone, 102288_ALDRICH, o-Hydroxy-.beta.-phenyl propiophenone, o-Hydroxy-beta-phenyl propiophenone, EINECS 222-521-4, 1-(2-Hydroxyphenyl)-3-phenylpropan-1-one, TL8002620, 42772-82-7

Molecular Formula: C15H14O2Molecular Weight: 226.270460 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 2

InChIKey: JCPGMXJLFWGRMZ-UHFFFAOYSA-N

• 2-Bromobenzyl Alcohol
IUPAC Name: (2-bromophenyl)methanol | CAS Registry Number: 18982-54-2
Synonyms: 2-Bromobenzyl alcohol, (2-Bromophenyl)methanol, o-Bromo-benzyl alcohol, Benzenemethanol, 2-bromo-, Benzyl alcohol, o-bromo-, o-BROMOPENZYL ALCOHOL, 184276_ALDRICH, AIDS017545, AIDS-017545, EINECS 242-719-4, ZINC01996019, ST5406681, InChI=1/C7H7BrO/c8-7-4-2-1-3-6(7)5-9/h1-4,9H,5H

Molecular Formula: C7H7BrOMolecular Weight: 187.033880 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 1

InChIKey: IOWGHQGLUMEZKG-UHFFFAOYSA-N

• 2',4'-Difluoroacetophenone
IUPAC Name: 1-(2,4-difluorophenyl)ethanone | CAS Registry Number: 364-83-0
Synonyms: Acetophenone, 2',4'-difluoro-, 264253_ALDRICH, Ethanone, 1-(2,4-difluorophenyl)-, 36863_FLUKA, ZINC00157303, CID67770, EINECS 206-667-6, 1-(2,4-Difluorophenyl)ethan-1-one, TL806298, T5792202

Molecular Formula: C8H6F2OMolecular Weight: 156.129446 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 3

InChIKey: QEWHNJPLPZOEKU-UHFFFAOYSA-N

• 2-Chlorotoluene
IUPAC Name: 1-chloro-2-methylbenzene | CAS Registry Number: 95-49-8
Synonyms: o-Chlorotoluene, o-Tolyl chloride, Toluene, o-chloro-, 1-Chloro-2-methylbenzene, ortho-Chlorotoluene, Benzene, 1-chloro-2-methyl-, 2-Methylchlorobenzene, Halso 99, 2-Chloro-1-methylbenzene, TOLUENE,2-CHLORO, 1-METHYL-2-CHLOROBENZENE, CCRIS 7785, HSDB 5291, 47797_SUPELCO, 111910_ALDRICH, 36695_RIEDEL, NSC 8766, 26530_FLUKA, EINECS 202-424-3, NSC8766

Molecular Formula: C7H7ClMolecular Weight: 126.583480 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 0

InChIKey: IBSQPLPBRSHTTG-UHFFFAOYSA-N

• 2-Amino Anthraquinone
IUPAC Name: 2-aminoanthracene-9,10-dione | CAS Registry Number: 117-79-3
Synonyms: 2-AMINOANTHRAQUINONE, Aminoanthraquinone, Anthraquinone, 2-amino-, beta-Anthraquinonylamine, beta-Aminoanthraquinone, 2-Amino-9,10-anthraquinone, 9,10-Anthracenedione, 2-amino-, CCRIS 23, NSC5, .beta.-Aminoanthraquinone, NSC 5, 2-Amino-9,10-anthracenedione, CBMicro_011266, 2-Aminoanthra-9,10-quinone, 2-AAQ, NCI-C01876, HSDB 4088, MLS002152869, 165549_ALDRICH, EINECS 204-208-4

Molecular Formula: C14H9NO2Molecular Weight: 223.226760 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 3

InChIKey: XOGPDSATLSAZEK-UHFFFAOYSA-N

• 2-Amino-3,5-Dichloropyridine
IUPAC Name: 3,5-dichloropyridin-2-amine | CAS Registry Number: 4214-74-8
Synonyms: 2-Amino-3,5-dichloropyridine, 2-Pyridinamine, 3,5-dichloro-, 3,5-Dichloro-3-pyridylamine, 3,5-Dichloro-2-aminopyridine, 135925_ALDRICH, 3,5-dichloropyridin-2-ylamine, Pyridine, 2-amino-3,5-dichloro-, NSC51586, EINECS 224-143-5, SBB003932, A177, AC-907/25014045, InChI=1/C5H4Cl2N2/c6-3-1-4(7)5(8)9-2-3/h1-2H,(H2,8,9

Molecular Formula: C5H4Cl2N2Molecular Weight: 163.004660 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 2

InChIKey: OCWBGKZFOYMCCN-UHFFFAOYSA-N

• 2-Amino-6-Chloro Benzothiazole
IUPAC Name: 6-chloro-1,3-benzothiazol-2-amine | CAS Registry Number: 95-24-9
Synonyms: 2-Amino-6-chlorobenzothiazole, 2-Benzothiazolamine, 6-chloro-, Maybridge1_001187, 6-Chlorobenzothiazol-2-ylamine, MLS001005225, 136085_ALDRICH, EINECS 202-402-3, BRN 0127752, SBB000249, ZINC00119437, BENZOTHIAZOLE, 2-AMINO-6-CHLORO-, LS-40664, SMR000348635, 4-27-00-04862 (Beilstein Handbook Reference), SR-01000641019-1, InChI=1/C7H5ClN2S/c8-4-1-2-5-6(3-4)11-7(9)10-5/h1-3H,(H2,9,10

Molecular Formula: C7H5ClN2SMolecular Weight: 184.646000 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 2

InChIKey: VMNXKIDUTPOHPO-UHFFFAOYSA-N

• 2-Chloropropionyl Chloride
IUPAC Name: 2-chloropropanoyl chloride | CAS Registry Number: 7623-09-8
Synonyms: 2-Chloropropionyl chloride, .alpha.-Chloropropionyl chloride, Propanoyl chloride, 2-chloro-, 157139_ALDRICH, 26200_FLUKA, EINECS 231-540-7, 76248-57-2

Molecular Formula: C3H4Cl2OMolecular Weight: 126.969260 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 1

InChIKey: JEQDSBVHLKBEIZ-UHFFFAOYSA-N

• 2,6-Dichlorobenzyl Cyanide
IUPAC Name: 2-(2,6-dichlorophenyl)acetonitrile | CAS Registry Number: 3215-64-3
Synonyms: 2,6-Dichlorobenzyl cyanide, (2,6-Dichlorophenyl)acetonitrile, NCIOpen2_000517, 2,6-Dichlorophenylacetonitrile, 126012_ALDRICH, 2,6-Dichlorobenzeneacetonitrile, Acetonitrile, (2,6-dichlorophenyl)-, NSC72901, Benzeneacetonitrile, 2,6-dichloro-, CID76678, EINECS 221-730-8, ZINC00388165, ST5406205

Molecular Formula: C8H5Cl2NMolecular Weight: 186.038000 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 1

InChIKey: AOEJUUCUKRUCEF-UHFFFAOYSA-N

• 2,6-Dichlorofluorobenzene
IUPAC Name: 1,3-dichloro-2-fluorobenzene | CAS Registry Number: 2268-05-5
Synonyms: 1,3-Dichloro-2-fluorobenzene, 323918_ALDRICH, CID137520, ST5405437, InChI=1/C6H3Cl2F/c7-4-2-1-3-5(8)6(4)9/h1-3

Molecular Formula: C6H3Cl2FMolecular Weight: 164.992423 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 1

InChIKey: JORVCRLRRRRLFI-UHFFFAOYSA-N

• 2,6-Dihydroxy Acetophenone
IUPAC Name: 1-(2,6-dihydroxyphenyl)ethanone | CAS Registry Number: 699-83-2
Synonyms: 2-Acetylresorcinol, 2',6'-Dihydroxyacetophenone, 2,6-Dihydroxyacetophenone, gamma-Resacetophenone, Resorcinol, 2-acetyl-, .gamma.-Resacetophenone, 1,3-Benzenediol, 2-acetyl-, D107808_ALDRICH, 1-(2,6-Dihydroxyphenyl)ethanone, 2-Acetyl-1,3-dihydroxybenzene, NSC615, 37468_FLUKA, NSC 615, Acetophenone, 2',6'-dihydroxy-, EINECS 211-833-6, ZINC00157768, Ethanone, 1-(2,6-dihydroxyphenyl)-, LS-3428, NCGC00166008-01, Acetophenone, 2',6'-dihydroxy- (8CI)

Molecular Formula: C8H8O3Molecular Weight: 152.147320 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 3

InChIKey: YPTJKHVBDCRKNF-UHFFFAOYSA-N

• 2-Acetyl Phenothiazine
IUPAC Name: 1-(10H-phenothiazin-2-yl)ethanone | CAS Registry Number: 6631-94-3
Synonyms: 2-Acetylphenothiazine, 3-Acetylphenothiazine, MLS000047624, 1-(10H-Phenothiazin-2-yl)ethanone, Methyl phenothiazin-2-yl ketone, Ethanone, 1-(10H-phenothiazin-2-yl)-, NSC57951, EINECS 229-626-4, NSC169669, STK301831, ZINC00119687, SMR000033635, AK-968/41128722, SR-01000597201-3, InChI=1/C14H11NOS/c1-9(16)10-6-7-14-12(8-10)15-11-4-2-3-5-13(11)17-14/h2-8,15H,1H

Molecular Formula: C14H11NOSMolecular Weight: 241.308240 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 2

InChIKey: JWGBOHJGWOPYCL-UHFFFAOYSA-N

• 2-Ethylhexylamine
IUPAC Name: 2-ethylhexan-1-amine | CAS Registry Number: 104-75-6
Synonyms: 2-Ethylhexanamine, Hexylamine, 2-ethyl-, 2-Ethyl hexylamine, beta-Ethylhexylamine, 1-Hexanamine, 2-ethyl-, 2-ETHYLHEXYLAMINE, 2-ethylhexan-1-amine, 2-Ethyl-1-hexylamine, CCRIS 4646, 1-Amino-2-ethylhexan [Czech], E29508_ALDRICH, EINECS 203-233-8, UN2276, BRN 1209249, LS-379, SBB006745, AI3-26287, NCGC00090936-01, NCGC00090936-02, 2-Ethylhexylamine [UN2276] [Flammable liquid]

Molecular Formula: C8H19NMolecular Weight: 129.243160 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 1

InChIKey: LTHNHFOGQMKPOV-UHFFFAOYSA-N

• 1,6-Hexanedithiol
IUPAC Name: hexane-1,6-dithiol | CAS Registry Number: 1191-43-1
Synonyms: 1,6-Dimercaptohexane, 1,6-HEXANEDITHIOL, USAF uctl-72, 1,6-Hexanedimercaptan, Hexamethylene dimercaptan, Hexane-1,6-dithiol, 1,6-Hexamethylenedithiol, WLN: SH6SH, FEMA No. 3495, H12005_ALDRICH, W349518_ALDRICH, NDR-139, 52820_FLUKA, EINECS 214-735-1, NSC 29031, NSC29031, BRN 1732507, ZINC03860476, LS-75126, 4-01-00-02559 (Beilstein Handbook Reference)

Molecular Formula: C6H14S2Molecular Weight: 150.305360 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 0

InChIKey: SRZXCOWFGPICGA-UHFFFAOYSA-N

• 2-Amino-5-nitrobenzotrifluoride
IUPAC Name: 4-nitro-2-(trifluoromethyl)aniline | CAS Registry Number: 121-01-7
Synonyms: 196576_ALDRICH, 4-Nitro-2-(trifluoromethyl)aniline, 4-Nitro-a,a,a-trifluoro-o-toluidine, ZINC03861425, CID67128, EINECS 204-443-2, 4-Nitro-alpha,alpha,alpha-trifluoro-o-toluidine, ST5308325, TL8000553, T0517-6175, InChI=1/C7H5F3N2O2/c8-7(9,10)5-3-4(12(13)14)1-2-6(5)11/h1-3H,11H

Molecular Formula: C7H5F3N2O2Molecular Weight: 206.122010 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 6

InChIKey: HOTZLWVITTVZGY-UHFFFAOYSA-N

• (R)-(+)-alpha, alpha-Diphenyl-2-pyrrolidinemethanol
IUPAC Name: di(phenyl)-[(2R)-pyrrolidin-1-ium-2-yl]methanol | CAS Registry Number: 22348-32-9
Synonyms: ZINC03632771

Molecular Formula: C17H20NO+Molecular Weight: 254.346800 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 1

InChIKey: OGCGXUGBDJGFFY-MRXNPFEDSA-O

• 2-(2H-Benzotriazol-2-yl)-4,6-ditertpentylphenol
IUPAC Name: 2-(benzotriazol-2-yl)-4,6-bis(2-methylbutan-2-yl)phenol | CAS Registry Number: 25973-55-1
Synonyms: CBDivE_008185, 422746_ALDRICH, EINECS 247-384-8, ZINC02013193, NCGC00164178-01, BAS 00165207, LS-179308, Phenol, 2-(2H-benzotriazol-2-yl)-4,6-di-tert-pentyl-, Phenol, 2-(2H-benzotriazol-2-yl)-4,6-bis(1,1-dimethylpropyl)-, 2-(2H-Benzotriazol-2-yl)-4,6-di-tert-pentylphenol, 2-(2H-BENZOTRIAZOL-2-YL)-4,6-DI(T-PENTYL)PHENOL, 2-Benzotriazol-2-yl-4,6-bis-(1,1-dimethyl-propyl)-phenol, A2445/0103683, 2-(2H-benzotriazol-2-yl)-4,6-bis(1,1-dimethylpropyl)phenol, 102257-30-7, 104817-16-5, 131242-53-0, 134018-57-8, 153613-73-1, 186805-09-4

Molecular Formula: C22H29N3OMolecular Weight: 351.485160 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 4

InChIKey: ZMWRRFHBXARRRT-UHFFFAOYSA-N

• 2-Cyanopyrimidine
IUPAC Name: pyrimidine-2-carbonitrile | CAS Registry Number: 14080-23-0
Synonyms: pyrimidine-2-carbonitrile, 2-Pyrimidinecarbonitrile, AG-D-81557, F2173-0037, 2-cyano-pyrimidine, 2-Cyano pyrimidine, Pyrimidinecarbonitrile, ZINC02531032, zlchem 283, PubChem7042, 2CPM, ACMC-1BOY6, AGN-PC-0D4UNG, SureCN151679, AC1MBX40, SureCN2643396, 2-CPY, KSC138C0F, 646830_ALDRICH, AC1Q4R59

Molecular Formula: C5H3N3Molecular Weight: 105.097420 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 3

InChIKey: IIHQNAXFIODVDU-UHFFFAOYSA-N

• (2r)-2-Piperazine Carboxylic Acid
• 2,2'-Diamino diphenyl disulfide
IUPAC Name: 2-(2-aminophenyl)disulfanylaniline | CAS Registry Number: 1141-88-4
Synonyms: Intramine, 2,2'-Dithiodianiline, Aniline, 2,2'-dithiodi-, 2-Aminophenyl disulfide, o,o-Dithio-bis-aniline, Benzenamine, 2,2'-dithiobis-, Bis(2-aminophenyl) disulfide, Bis(o-aminophenyl) disulfide, 2,2'-Diaminodiphenyl disulfide, 2,2'-Dithiobis(aniline), USAF AB-315, Bis(2-aminophenyl)disulfide, o,o'-Diaminodiphenyl disulfide, Disulfide, bis(2-aminophenyl), o,o-Dithio-bis(aniline), WLN: ZR BSSR BZ, 2,2'-Diaminodiphenyldisulfide, Disulfide, bis(o-aminophenyl)-, o,o'-Diamino diphenyl disulfide, ANILINE, 2,2'-DITHIOBIS-

Molecular Formula: C12H12N2S2Molecular Weight: 248.367080 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 2

InChIKey: YYYOQURZQWIILK-UHFFFAOYSA-N

• 1,5-Dichloroanthraquinone
IUPAC Name: 1,5-dichloroanthracene-9,10-dione | CAS Registry Number: 82-46-2
Synonyms: 1,5-Dichloranthrachinon, 1,5-Dichloroantraquinone, Maybridge1_002222, CBMicro_015239, 9,10-Anthracenedione, 1,5-dichloro-, ANTHRAQUINONE, 1,5-DICHLORO-, 1,5-Dichloro-9,10-anthraquinone, D56209_ALDRICH, 1,5-Dichloranthrachinon [Czech], EINECS 201-424-0, NSC 13969, AIDS017899, 1,5-Dichloroanthra-9,10-quinone, AIDS-017899, NSC13969, SBB001110, ZINC03860347, WLN: L C666 BV IVJ DG KG, AI3-38301, LS-20661

Molecular Formula: C14H6Cl2O2Molecular Weight: 277.102240 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 2

InChIKey: MQIUMARJCOGCIM-UHFFFAOYSA-N

• (R)-(-)-sec-Butylamine
IUPAC Name: butan-2-amine | CAS Registry Number: 13250-12-9
Synonyms: 2-Butanamine, Deccotane, Butafume, Frucote, Tutane, SEC-BUTYLAMINE, 2-Aminobutane, 2-Butylamine, 1-Methylpropanamine, 1-Methylpropylamine, 2-Aminobutane base, butan-2-amine, S-2-Butylamine, Butylamine [ISO], sec-Butylamine, (S)-, (S)-sec-Butylamine, (S)-2-Aminobutane, (+)-2-Butylamine, (RS)-sec-Butylamine, Caswell No. 125

Molecular Formula: C4H11NMolecular Weight: 73.136840 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 1

InChIKey: BHRZNVHARXXAHW-UHFFFAOYSA-N

• 2,5-Difluoroaniline
IUPAC Name: 2,5-difluoroaniline | CAS Registry Number: 367-30-6
Synonyms: Aniline, 2,5-difluoro-, Benzenamine, 2,5-difluoro-, Ambap3048, 196606_ALDRICH, NSC3259, JRD-0068, EINECS 206-690-1, ZINC00388527, AI3-52637, TL8002713, InChI=1/C6H5F2N/c7-4-1-2-5(8)6(9)3-4/h1-3H,9H

Molecular Formula: C6H5F2NMolecular Weight: 129.107406 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 3

InChIKey: YNOOQIUSYGWMSS-UHFFFAOYSA-N

• 2'-fluoropropiophenone
IUPAC Name: 1-(2-fluorophenyl)propan-1-one | CAS Registry Number: 446-22-0
Synonyms: 2-Fluoropropiophenone, 2'-Fluoropropiophenone, Ambap1683, 1-(2-Fluorophenyl)-1-propanone, ZINC00409283, TL8003116

Molecular Formula: C9H9FOMolecular Weight: 152.165563 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 2

InChIKey: NSNSIFGTEGKZFK-UHFFFAOYSA-N

• 6-chloro-2-methylpyridine
IUPAC Name: 2-chloro-6-methylpyridine | CAS Registry Number: 18368-63-3
Synonyms: 6-Chloro-2-picoline, 2-Chloro-6-methylpyridine, 2-Picoline, 6-chloro-, Ambap4544, 6-Chloro-2-methylpyridine, Pyridine, 2-chloro-6-methyl-, 116335_ALDRICH, EINECS 242-241-6, ALBB-006135, ZINC00388111, C234, LS-184968

Molecular Formula: C6H6ClNMolecular Weight: 127.571540 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 1

InChIKey: GXZDYRYYNXYPMQ-UHFFFAOYSA-N

• 2-Nitro-para-Phenylene Diamine
IUPAC Name: 2-nitrobenzene-1,4-diamine | CAS Registry Number: 5307-14-2
Synonyms: Durafur Brown, Fouramine 2R, Ursol Brown RR, Zoba Brown RR, Durafur Brown 2R, Fourrine 36, Fourrine Brown 2R, Oxidation base 22, Dye GS, du rafur brown, Nitro-p-phenylenediamine, o-Nitro-p-phenylenediamine, 2,5-Diaminonitrobenzene, 4-Amino-2-nitroaniline, 1,4-Diamino-2-nitrobenzene, p-Phenylenediamine, 2-nitro-, 2-NITRO-P-PHENYLENEDIAMINE, 2-Nitro-1,4-phenylenediamine, 2-Nitro-1,4-benzenediamine, 2-Nitro-4-aminoaniline

Molecular Formula: C6H7N3O2Molecular Weight: 153.138680 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 4

InChIKey: HVHNMNGARPCGGD-UHFFFAOYSA-N

• 2-Chloromandelic acid
IUPAC Name: 2-(2-chlorophenyl)-2-hydroxyacetic acid | CAS Registry Number: 10421-85-9
Synonyms: Maybridge3_004881, (2-Chlorophenyl)glycolic acid, 530182_ALDRICH, NSC31401, EINECS 233-900-9, NSC 31401, SBB003705, IDI1_016268, AI3-07572, Benzeneacetic acid, 2-chloro-alpha-hydroxy-, SR-01000640397-1

Molecular Formula: C8H7ClO3Molecular Weight: 186.592380 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 3

InChIKey: RWOLDZZTBNYTMS-UHFFFAOYSA-N

• 1-Nitroso-2-naphthol
IUPAC Name: 1-nitrosonaphthalen-2-ol | CAS Registry Number: 131-91-9
Synonyms: 2-Naphthol, 1-nitroso-, 2-Naphthalenol, 1-nitroso-, Nitroso-beta-naphthol, .alpha.-Nitrosonaphthol, Nitroso-.beta.-naphthol, Zelen moridlova 4 [Czech], 1-Nitroso-2-naftol [Czech], CCRIS 1556, WLN: L66J BNO CQ, 1,2-Naphthoquinone 1-oxime, 1,2-Naphthoquinone, 1-oxime, 114693_ALDRICH, alpha-Nitroso-beta-naftol [Czech], 1,2-Naphthalenedione, 1-oxime, NSC 4151, EINECS 205-043-0, .alpha.-Nitroso-.beta.-naphthol, 1-NITROSO-2-NAPHTHALENOL, NSC4151, NSC677525

Molecular Formula: C10H7NO2Molecular Weight: 173.168080 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 3

InChIKey: YXAOOTNFFAQIPZ-UHFFFAOYSA-N

• 2-Ethylphenylhydrazine hydrochloride
IUPAC Name: (2-ethylphenyl)hydrazine | CAS Registry Number: 19398-06-2
Synonyms: (2-ethylphenyl)hydrazine, (2-Ethyl-phenyl)-hydrazine, Oprea1_325783, ZINC00154746, ALBB-005992, BBV-050819, CID2733210, 58711-02-7

Molecular Formula: C8H12N2Molecular Weight: 136.194280 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 2

InChIKey: JHPOWXCLWLEKBY-UHFFFAOYSA-N

• 2-Chlorobenzenesulphonyl chloride
IUPAC Name: 2-chlorobenzenesulfonyl chloride | CAS Registry Number: 2905-23-9
Synonyms: 2-Chlorobenzenesulfonyl chloride, o-Chlorobenzenesulfochloride, Benzenesulfonyl chloride, 2-chloro-, o-Chlorobenzenesulfonyl chloride, 546925_ALDRICH, EINECS 220-807-3, ALBB-000997, BRN 0974321, NSC151229, LS-32137, ST5411802, Benzenesulfonyl chloride, o-chloro- (6CI,7CI,8CI), 4-11-00-00106 (Beilstein Handbook Reference)

Molecular Formula: C6H4Cl2O2SMolecular Weight: 211.065760 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 2

InChIKey: KMVZDSQHLDGKGV-UHFFFAOYSA-N

• 3-Ethoxy-2-methylpyrazine
IUPAC Name: 2-ethoxy-3-methylpyrazine | CAS Registry Number: 32737-14-7
Synonyms: 2-Ethoxy-3-methylpyrazine, 2-Methyl-3-ethoxypyrazine, 2-Methyl-5-ethoxypyrazine, Pyrazine, 2-ethoxy-3-methyl-, W356905_ALDRICH, FEMA No. 3569, EINECS 251-184-6, 2-Ethoxy-3(5 or 6)-methylpyrazine, mixture, 2-Methyl-3(5 or 6)-ethoxypyrazine, mixture, InChI=1/C7H10N2O/c1-3-10-7-6(2)8-4-5-9-7/h4-5H,3H2,1-2H

Molecular Formula: C7H10N2OMolecular Weight: 138.167100 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 3

InChIKey: MMKWCKGYULOKET-UHFFFAOYSA-N

• 2,5-Difluoronitrobenzene
IUPAC Name: 1,4-difluoro-2-nitrobenzene | CAS Registry Number: 364-74-9
Synonyms: 1,4-Difluoro-2-nitrobenzene, Benzene, 1,4-difluoro-2-nitro-, 196622_ALDRICH, EINECS 206-663-4, NSC 528657, BRN 2210200, NSC528657, ZINC00164551, LS-29843, SB 01118, TL8002687, 4-05-00-00720 (Beilstein Handbook Reference)

Molecular Formula: C6H3F2NO2Molecular Weight: 159.090326 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 4

InChIKey: XNJAYQHWXYJBBD-UHFFFAOYSA-N

• (R)-(+)-N-Benzyl-alpha-methylbenzylamine
IUPAC Name: cyclohexylmethyl-[(1R)-1-phenylethyl]azanium | CAS Registry Number: 38235-77-7
Synonyms: ZINC04167527, CID7119428

Molecular Formula: C15H24N+Molecular Weight: 218.357760 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 0

InChIKey: UHABCGJJMSQRRP-CYBMUJFWSA-O

• 1,2,4-Benzenetriol
IUPAC Name: benzene-1,2,4-triol | CAS Registry Number: 533-73-3
Synonyms: Hydroxyquinol, Hydroxyhydroquinone, 1,2,4-BENZENETRIOL, Oxyhydroquinone, 1,2,4-Trihydroxybenzene, Benzene-1,2,4-triol, 4-Hydroxycatechol, 2,5-Dihydroxyphenol, Hydroquinone, hydroxy-, Ambap71, 1,3,4-Benzenetriol, 1,3,4-Trihydroxybenzene, Oxyhydrochinon [German], WLN: QR BQ DQ, CCRIS 2987, 173401_ALDRICH, NSC 2818, CHEBI:16971, EINECS 208-575-1, NSC2818

Molecular Formula: C6H6O3Molecular Weight: 126.110040 [g/mol]
H-Bond Donor: 3H-Bond Acceptor: 3

InChIKey: GGNQRNBDZQJCCN-UHFFFAOYSA-N


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