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• 2-Ethyl Pyrazine
IUPAC Name: 2-ethylpyrazine | CAS Registry Number: 13925-00-3
Synonyms: Ethylpyrazine, Pyrazine, ethyl-, Moldin, 2-ETHYLPYRAZINE, 2-Ethyl-1,4-diazine, FEMA No. 3281, CCRIS 2931, W328103_ALDRICH, 250384_ALDRICH, EINECS 237-691-5, AIDS081851, AIDS-081851, CID26331, BRN 0108200, ZINC04262348, LS-127612, ST5437416, 5-23-05-00402 (Beilstein Handbook Reference), InChI=1/C6H8N2/c1-2-6-5-7-3-4-8-6/h3-5H,2H2,1H, 1392-50-3

Molecular Formula: C6H8N2Molecular Weight: 108.141120 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 2

InChIKey: KVFIJIWMDBAGDP-UHFFFAOYSA-N

• 2-Fluoroanisole
IUPAC Name: 1-fluoro-2-methoxybenzene | CAS Registry Number: 321-28-8
Synonyms: o-Fluoroanisole, Anisole, o-fluoro-, 1-Fluoro-2-methoxybenzene, Benzene, 1-fluoro-2-methoxy-, F4203_ALDRICH, NSC10339, EINECS 206-284-4, ZINC00388676, F104, ST5214395, TL8002441

Molecular Formula: C7H7FOMolecular Weight: 126.128283 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 2

InChIKey: JIXDOBAQOWOUPA-UHFFFAOYSA-N

• 4-Chloro-2,5-Dimethoxyaniline
IUPAC Name: 4-chloro-2,5-dimethoxyaniline | CAS Registry Number: 6358-64-1
Synonyms: 4-Chloro-2,5-dimethoxyaniline, Benzenamine, 4-chloro-2,5-dimethoxy-, 2,5-Dimethoxy-4-chloroaniline, 536385_ALDRICH, ANILINE, 4-CHLORO-2,5-DIMETHOXY-, WLN: 1OR BZ EG DO1, NSC60154, EINECS 228-782-0, NSC 60154, CID22833, BRN 0880445, SBB003681, ZINC00403975, NCGC00164199-01, LS-19646, 4-13-00-02556 (Beilstein Handbook Reference)

Molecular Formula: C8H10ClNO2Molecular Weight: 187.623500 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 3

InChIKey: YGUFQYGSBVXPMC-UHFFFAOYSA-N

• 2-Butanone Oxime
IUPAC Name: (NZ)-N-butan-2-ylidenehydroxylamine | CAS Registry Number: 96-29-7
Synonyms: Butanone oxime, MEK-oxime, 2-Butanone, oxime, Ethyl methyl ketoxime, Methyl ethyl ketoxime, Troykyd anti-skin B, Skino #2, 2-BUTANONE OXIME, Ethyl methyl ketone oxime, Methyl ethyl ketone oxime, USAF AM-3, USAF EK-906, (2Z)-butan-2-one oxime, USAF DO-44, WLN: QNUY2&1, Ethyl-methylketonoxim [Czech], 2-butanone, oxime, (2Z)-, CCRIS 1382, NSC442, NSC 442

Molecular Formula: C4H9NOMolecular Weight: 87.120360 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 2

InChIKey: WHIVNJATOVLWBW-PLNGDYQASA-N

• 2-Mercapto-3-Butanol
IUPAC Name: 3-sulfanylbutan-2-ol | CAS Registry Number: 37887-04-0
Synonyms: 2-Mercapto-3-butanol, 3-Mercapto-2-butanol, 2-Hydroxy-3-butanethiol, 3-Hydroxy-2-butanethiol, 2-Butanol, 3-mercapto-, W350206_ALDRICH, FEMA No. 3502, 264792_ALDRICH, (R*,S*)-3-Mercaptobutan-2-ol, EINECS 253-701-0, 2-Butanol, 3-mercapto-, (theta,S)-, 3-Mercapto-2-butanol, mixture of isomers, LS-179775, 54812-86-1

Molecular Formula: C4H10OSMolecular Weight: 106.186600 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 1

InChIKey: MJQWABQELVFQJL-UHFFFAOYSA-N

• 2-Chloro-5-Nitroaniline
IUPAC Name: 2-chloro-5-nitroaniline | CAS Registry Number: 6283-25-6
Synonyms: 6-Chloro-3-nitroaniline, Aniline, 2-chloro-5-nitro-, Benzenamine, 2-chloro-5-nitro-, 2-CHLORO-5-NITROANILINE, 2-Chloro-5-nitrobenzenamine, WLN: ZR BG ENW, Aniline, 6-chloro-3-nitro-, C58150_ALDRICH, HSDB 6086, NSC7791, NSC 7791, EINECS 228-498-7, 2-Amino-1-chloro-4-nitrobenzene, CID22691, BRN 2208878, SBB003829, ZINC01688375, LS-19666, 3-12-00-01661 (Beilstein Handbook Reference), InChI=1/C6H5ClN2O2/c7-5-2-1-4(9(10)11)3-6(5)8/h1-3H,8H

Molecular Formula: C6H5ClN2O2Molecular Weight: 172.569100 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 3

InChIKey: KWIXNFOTNVKIGM-UHFFFAOYSA-N

• 1,8-Diamino Naphthalene
IUPAC Name: naphthalene-1,8-diamine | CAS Registry Number: 479-27-6
Synonyms: 1,8-Naphthalenediamine, Naphthalene-1,8-diamine, 1,8-Diaminonaphthalene, 1,8-Naphthylenediamine, D21405_ALDRICH, NSC 6081, 33170_FLUKA, 33180_FLUKA, EINECS 207-529-8, NSC6081, ZINC00388487, 1,8-NAPHTHYLENEDIAMINE, TECH, AI3-03804, LS-167531, InChI=1/C10H10N2/c11-8-5-1-3-7-4-2-6-9(12)10(7)8/h1-6H,11-12H

Molecular Formula: C10H10N2Molecular Weight: 158.199800 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 2

InChIKey: YFOOEYJGMMJJLS-UHFFFAOYSA-N

• (R)-(+)-4-Hydroxy-2-Pyrrolidinone
IUPAC Name: (4R)-4-hydroxypyrrolidin-2-one | CAS Registry Number: 22677-21-0
Synonyms: 479160_ALDRICH, (R)-beta-Hydroxy-gamma-butyrolactam, (R)-()-4-Hydroxy-2-pyrrolidinone, (R)-(+)-4-Hydroxy-2-pyrrolidinone, TL8001902

Molecular Formula: C4H7NO2Molecular Weight: 101.103880 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 2

InChIKey: IOGISYQVOGVIEU-GSVOUGTGSA-N

• 1-AdamantaneCarboxylic acid
IUPAC Name: adamantane-1-carboxylic acid | CAS Registry Number: 828-51-3
Synonyms: Adamantoic acid, 1-Carboxyadamantane, 1-Adamantanecarboxylic acid, Adamantanecarboxylic acid, Adamantane-1-carboxylic acid, Enamine_000586, Adamantane-2-carboxylic acid, Oprea1_849468, 106399_ALDRICH, 3-ADAMANTANECARBOXYLIC ACID, 01823_FLUKA, EINECS 212-584-6, NSC 94182, 1-Adamantanecarboxylic acid (8CI), CID13235, NSC94182, SBB015170, AI3-52431, LS-14967, Tricyclo(3.3.1.1'3,7)decane-1-carboxylic acid

Molecular Formula: C11H16O2Molecular Weight: 180.243540 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 2

InChIKey: JIMXXGFJRDUSRO-UHFFFAOYSA-N

• 2,6-Dimethyl Pyrazine
IUPAC Name: 2,6-dimethylpyrazine | CAS Registry Number: 108-50-9
Synonyms: 2,6-Dimethylpiazine, 3,5-Dimethylpyrazine, 2,6-DIMETHYLPYRAZINE, Pyrazine, 2,6-dimethyl-, 2,6-Dimethylparadiazine, 2,6-Dimethyl-1,4-diazine, FEMA No. 3273, CCRIS 2930, 2,6-Dimethylpyrazine (natural), D181803_ALDRICH, W327301_ALDRICH, EINECS 203-589-4, ZINC00404377, LS-2695, InChI=1/C6H8N2/c1-5-3-7-4-6(2)8-5/h3-4H,1-2H

Molecular Formula: C6H8N2Molecular Weight: 108.141120 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 2

InChIKey: HJFZAYHYIWGLNL-UHFFFAOYSA-N

• 2-(1-Naphthyl) Acetamide
IUPAC Name: 2-naphthalen-1-ylacetamide | CAS Registry Number: 86-86-2
Synonyms: Rootone, Frufix, Amid-Thin, Dirigol N, 1-Naphthylacetamide, Amid-Thin W, NAAm, Fruitone, Rosetone, Naamide, alpha-NAA amide, Naphthaleneacetamide, 1-NAPHTHALENEACETAMIDE, alpha-Naphthylacetamide, Caswell No. 588, Naphthalene acetamide, 1-Naphthalene acetamide, 2-(1-Naphthyl)acetamide, 1-Naphthyl-acetamide, alpha-Naphthaleneacetamide

Molecular Formula: C12H11NOMolecular Weight: 185.221840 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 1

InChIKey: XFNJVKMNNVCYEK-UHFFFAOYSA-N

• 2-Chloro-4-Fluoro Benzoic Acid
IUPAC Name: 2-chloro-4-fluorobenzoic acid | CAS Registry Number: 2252-51-9
Synonyms: 2-Chloro-4-fluorobenzoic acid, 297836_ALDRICH, Benzoic acid, 2-chloro-4-fluoro-, 2-chloro-4-fluor obenzoic acid, JRD-0875, EINECS 218-845-0, SBB003795, TL806106, InChI=1/C7H4ClFO2/c8-6-3-4(9)1-2-5(6)7(10)11/h1-3H,(H,10,11

Molecular Formula: C7H4ClFO2Molecular Weight: 174.556863 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 3

InChIKey: GRPWQLDSGNZEQE-UHFFFAOYSA-N

• 2-Chloro-4-NitroBenzoic Acid
IUPAC Name: 2-chloro-4-nitrobenzoic acid | CAS Registry Number: 99-60-5
Synonyms: 2-CHLORO-4-NITROBENZOIC ACID, WLN: WNR CG DVQ, Benzoic acid, 2-chloro-4-nitro-, NSC150, C59602_ALDRICH, NSC 150, 25410_FLUKA, EINECS 202-771-0, AIDS019397, Kyselina 2-chloro-4-nitrobenzoova, AIDS-019397, BRN 1912836, SBB000403, AI3-33426, Kyselina 2-chloro-4-nitrobenzoova [Czech], LS-36571, TL80073611, 4-09-00-01229 (Beilstein Handbook Reference), InChI=1/C7H4ClNO4/c8-6-3-4(9(12)13)1-2-5(6)7(10)11/h1-3H,(H,10,11

Molecular Formula: C7H4ClNO4Molecular Weight: 201.563960 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 4

InChIKey: QAYNSPOKTRVZRC-UHFFFAOYSA-N

• 2-Chloro-6-Fluoro Toluene
IUPAC Name: 1-chloro-3-fluoro-2-methylbenzene | CAS Registry Number: 443-83-4
Synonyms: 2-Chloro-6-fluorotoluene, 1-Chloro-3-fluoro-2-methylbenzene, 141224_ALDRICH, 2-FLUORO-6-CHLOROTOLUENE, Benzene, 1-chloro-3-fluoro-2-methyl-, CID9933, ZINC00164391, EINECS 207-141-9, C110

Molecular Formula: C7H6ClFMolecular Weight: 144.573943 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 1

InChIKey: FNPVYRJTBXHIPB-UHFFFAOYSA-N

• 2-Ethoxy Pyrazine
IUPAC Name: 3-ethoxypyridazine | CAS Registry Number: 38028-67-0
Synonyms: Ethoxypyrazine, 2-Ethoxypyrazine, Pyrazine, ethoxy-, EINECS 253-750-8, CID520878

Molecular Formula: C6H8N2OMolecular Weight: 124.140520 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 3

InChIKey: ZVVWBPYZGKHHSR-UHFFFAOYSA-N

• 2-Hydroxy-5-Methyl Acetophenone
IUPAC Name: 1-(2-hydroxy-5-methylphenyl)ethanone | CAS Registry Number: 1450-72-2
Synonyms: o-Acetyl-p-cresol, 1-Hydroxy-2-acetyl-4-methylbenzene, 2-Hydroxy-5-methylacetophenone, NCIOpen2_000252, 2-ACETYL-4-METHYLPHENOL, H37601_ALDRICH, 2'-Hydroxy-5'-methylacetophenone, Ethanone, 1-(2-hydroxy-5-methylphenyl)-, NSC26458, NSC63363, EINECS 215-915-2, ZINC00088245, Acetophenone, 2'-hydroxy-5'-methyl-, SDCCGMLS-0065880.P001, A2494/0106055, InChI=1/C9H10O2/c1-6-3-4-9(11)8(5-6)7(2)10/h3-5,11H,1-2H

Molecular Formula: C9H10O2Molecular Weight: 150.174500 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 2

InChIKey: YNPDFBFVMJNGKZ-UHFFFAOYSA-N

• 2-Methoxy-3-Methyl Pyrazine
IUPAC Name: 2-methoxy-3-methylpyrazine | CAS Registry Number: 2847-30-5
Synonyms: (Methoxy)methylpyrazine, 2-METHOXY-3-METHYLPYRAZINE, Pyrazine, 2-methoxy-3-methyl-, 2-Methoxy-6-methylpyrazine, 2-Methyl-3-methoxypyrazine, 5-Methoxy-3-methylpyrazine, W318302_ALDRICH, FEMA No. 3183, 297941_ALDRICH, Pyrazine, 2-methoxy-6-methyl-, 2-Methoxy-3(or5)-methylpyrazine, EINECS 220-651-6, EINECS 220-737-3, EINECS 269-881-9, ZINC00405269, Pyrazine, 2-methoxy-3(or 5)-methyl-, ST5411503, 2- (5 or 6)-Methoxy-3-methylpyrazine (mixture of isomers), 2882-21-5, 63450-30-6

Molecular Formula: C6H8N2OMolecular Weight: 124.140520 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 3

InChIKey: VKJIAEQRKBQLLA-UHFFFAOYSA-N

• 2-Methyleneglutaronitrile
IUPAC Name: 2-methylidenepentanedinitrile | CAS Registry Number: 1572-52-7
Synonyms: Methylene glutaronitrile, Pentanedinitrile, 2-methylene-, 2-Methylenepentanedinitrile, Glutaronitrile, 2-methylene-, 125547_ALDRICH, EINECS 216-391-8, CID74080, LS-195310, InChI=1/C6H6N2/c1-6(5-8)3-2-4-7/h1-3H

Molecular Formula: C6H6N2Molecular Weight: 106.125240 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 2

InChIKey: NGCJVMZXRCLPRQ-UHFFFAOYSA-N

• 2,6-Dichloro Benzene Sulfonyl Chloride
IUPAC Name: 2,6-dichlorobenzenesulfonyl chloride | CAS Registry Number: 6579-54-0
Synonyms: 2,6-Dichlorobenzenesulfonyl chloride, 2,6-dichlorobenzene-1-sulfonyl chloride, 2,6-Dichlorobenzenesulfonylchloride, 2,6-Dichlorobenzenesulphonyl chloride, SBB055016, 2,6-dichloro-benzenesulfonyl chloride, 2,6-dichlorobenzene sulfonyl chloride, AG-G-47675, PubChem5117, AC1LAWLQ, ACMC-209ns8, DSSTox_CID_29303, DSSTox_RID_83421, DSSTox_GSID_49346, KSC491C3R, 545708_ALDRICH, AC1Q3K70, CTK3J1138, (2,6-dichlorophenyl)chlorosulfone, BUTTPARK 37\11-63

Molecular Formula: C6H3Cl3O2SMolecular Weight: 245.510820 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 2

InChIKey: WGGKQIKICKLWGN-UHFFFAOYSA-N

• 4-Hydroxyindole
IUPAC Name: 1H-indol-4-ol | CAS Registry Number: 2380-94-1
Synonyms: Hydroxyindole, 4-Indolol, 1H-Indol-4-ol, 4-hydroxyindole, 18, 219878_ALDRICH, EINECS 219-177-2, ZINC00153008, F2313G1, SDCCGMLS-0065859.P001, ST5330636, TL8001968, C02040, H-6000, H-6010

Molecular Formula: C8H7NOMolecular Weight: 133.147280 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 2

InChIKey: NLMQHXUGJIAKTH-UHFFFAOYSA-N

• 2-Chloro-4-fluorotoluene
IUPAC Name: 2-chloro-4-fluoro-1-methylbenzene | CAS Registry Number: 452-73-3
Synonyms: Ambap22, 247693_ALDRICH, Benzene, 2-chloro-4-fluoro-1-methyl-, NSC88317, EINECS 207-209-8, ZINC00164825, C108, TL8003145

Molecular Formula: C7H6ClFMolecular Weight: 144.573943 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 1

InChIKey: CSARJIQZOSVYHA-UHFFFAOYSA-N

• 2-Chloro-4'-fluorobenzophenone
IUPAC Name: (2-chlorophenyl)-(4-fluorophenyl)methanone | CAS Registry Number: 1806-23-1
Synonyms: 2-Chloro-4-fluorobenzophenone, NSC141026, CID74547, EINECS 217-300-4, ZINC00394857, Methanone, (2-chlorophenyl)(4-fluorophenyl)-, NSC 141026, ST5410014, TL8003007

Molecular Formula: C13H8ClFOMolecular Weight: 234.653423 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 2

InChIKey: DODIKYQYCCFWRZ-UHFFFAOYSA-N

• 2,6-Dichlorobenzaloxime
IUPAC Name: (NZ)-N-[(2,6-dichlorophenyl)methylidene]hydroxylamine | CAS Registry Number: 25185-95-9
Synonyms: ZINC00124443

Molecular Formula: C7H5Cl2NOMolecular Weight: 190.026700 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 2

InChIKey: YBSXDWIAUZOFFV-WMZJFQQLSA-N

• 2,5-Difluorobromobenzene
IUPAC Name: 2-bromo-1,4-difluorobenzene | CAS Registry Number: 399-94-0
Synonyms: 1-Bromo-2,5-difluorobenzene, 2-Bromo-1,4-difluorobenzene, 247952_ALDRICH, Benzene, 2-bromo-1,4-difluoro-, JRD-0410, NSC10250, EINECS 206-920-0, ZINC00160131, ST5405330, TL8002891, InChI=1/C6H3BrF2/c7-5-3-4(8)1-2-6(5)9/h1-3

Molecular Formula: C6H3BrF2Molecular Weight: 192.988826 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 2

InChIKey: XCRCSPKQEDMVBO-UHFFFAOYSA-N

• 2,4-Difluorotoluene
IUPAC Name: 2,4-difluoro-1-methylbenzene | CAS Registry Number: 452-76-6
Synonyms: Difluorotoluene, Ambap2874, Benzene, 2,4-difluoro-1-methyl-, 133892_ALDRICH, NSC3465, CID67983, EINECS 207-211-9, TL8003146

Molecular Formula: C7H6F2Molecular Weight: 128.119346 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 2

InChIKey: MPXDAIBTYWGBSL-UHFFFAOYSA-N

• 1H-1,2,4-Triazole-3-carboxylic acid
IUPAC Name: 1H-1,2,4-triazole-5-carboxylic acid | CAS Registry Number: 4928-87-4
Synonyms: 658472_ALDRICH, ZERO/004548, 1,2,4-Triazole-3-carboxylic acid, NSC165527, NSC202574, 1H-1,2,4-triazole-5-carboxylic acid, AE-848/32589003

Molecular Formula: C3H3N3O2Molecular Weight: 113.074820 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 5

InChIKey: LJVQHXICFCZRJN-UHFFFAOYSA-N

• 2,6-Difluorophenylacetonitrile
IUPAC Name: 2-(2,6-difluorophenyl)acetonitrile | CAS Registry Number: 654-01-3
Synonyms: 264512_ALDRICH, (2,6-Difluorophenyl)acetonitrile, Benzeneacetonitrile, 2,6-difluoro-, JRD-0487, EINECS 211-504-7, SBB006682, ZINC00409205

Molecular Formula: C8H5F2NMolecular Weight: 153.128806 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 3

InChIKey: GVAYBGQTAADLJS-UHFFFAOYSA-N

• (S)-(+)-2-Methylpiperazine
IUPAC Name: (2S)-2-methylpiperazine | CAS Registry Number: 74879-18-8
Synonyms: (S)-2-Methylpiperazine, (2S)-2-methylpiperazine, S-MP, (S)-2-Methyl-Piperazine, AG-G-98021, PIPERAZINE, 2-METHYL-, (2S)-, s-2-methylpiperazine, PubChem9701, PubChem15035, 2-(s)-methylpiperazine, (S)-3-Methylpiperazine, AC1MC0MO, (-)-2-Methylpiperazine, SureCN16558, UNII-C5VI3S1YC0, s-(+)-2-methylpiperazine, AC1Q29PO, 2-Methylpiperazine, (S)-, S-(-)-2-Methylpiperazine, s-(+)-2-methyl piperazine

Molecular Formula: C5H12N2Molecular Weight: 100.162180 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 2

InChIKey: JOMNTHCQHJPVAZ-YFKPBYRVSA-N

• 2-Aminophenethyl alcohol
IUPAC Name: 2-(2-aminophenyl)ethanol | CAS Registry Number: 5339-85-5
Synonyms: Benzeneethanol, 2-amino-, 2-(o-Aminophenyl)ethanol, o-Aminophenethyl alcohol, Phenethyl alcohol, o-amino-, 2-(2-Aminophenyl)ethanol, 192600_ALDRICH, NSC3572, Benzeneethanol, 2-amino- (9CI), NSC 3572, EINECS 226-275-9, AI3-18009, InChI=1/C8H11NO/c9-8-4-2-1-3-7(8)5-6-10/h1-4,10H,5-6,9H

Molecular Formula: C8H11NOMolecular Weight: 137.179040 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 2

InChIKey: ILDXSRFKXABMHH-UHFFFAOYSA-N

• 2,5-Dithiobiurea (Dithiamide)
IUPAC Name: (carbamothioylamino)thiourea | CAS Registry Number: 142-46-1
Synonyms: Dithiobiurea, Bithiourea, Dithiourea, Bis(thiourea), Dithiobiuret, 2,5-DITHIOBIUREA, 2,5-Dithiodiurea, Bithiourea (VAN), Biurea, 2,5-dithio-, Dithiocarbamoylhydrazine, Dithiobiurea (VAN), 2,5-dithiourea, Hydrazodicarbothioamide, Bisthiocarbamyl hydrazine, 1,2-Hydrazinedicarbothioamide, USAF ek-p-6281, WLN: SUYZMMYZUS, Dithiocarbamoyl hydrazine, USAF B-44, USAF B-55

Molecular Formula: C2H6N4S2Molecular Weight: 150.225840 [g/mol]
H-Bond Donor: 4H-Bond Acceptor: 0

InChIKey: KCOYHFNCTWXETP-UHFFFAOYSA-N

• 1,8-Dinitronaphthalene
IUPAC Name: 1,8-dinitronaphthalene | CAS Registry Number: 602-38-0
Synonyms: 1,8-DINITRONAPHTHALENE, Naphthalene, 1,8-dinitro-, CCRIS 2840, NSC 6323, CHEBI:50642, EINECS 210-016-1, NSC6323, BRN 1881846, ZINC01693402, AI3-08844, LS-1434, 4-05-00-01681 (Beilstein Handbook Reference), InChI=1/C10H6N2O4/c13-11(14)8-5-1-3-7-4-2-6-9(10(7)8)12(15)16/h1-6

Molecular Formula: C10H6N2O4Molecular Weight: 218.165640 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 4

InChIKey: AVCSMMMOCOTIHF-UHFFFAOYSA-N

• 1,1-Di(tert-Butylperoxy)cyclohexane
IUPAC Name: 1,1-bis(tert-butylperoxy)cyclohexane | CAS Registry Number: 3006-86-8
Synonyms: 531758_ALDRICH, Cyclohexylidenebis(tert-butyl) peroxide, CID76359, EINECS 221-111-2, 1,1-Bis(tert-butylperoxy)cyclohexane solution, Peroxide, cyclohexylidenebis((1,1-dimethylethyl), 1,1-Bis(tert-butylperoxy)cyclohexane (Luperox(R) 331M80) solution

Molecular Formula: C14H28O4Molecular Weight: 260.369720 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 4

InChIKey: HSLFISVKRDQEBY-UHFFFAOYSA-N

• (S)-(+)-2-Aminoheptane
IUPAC Name: (2S)-heptan-2-amine | CAS Registry Number: 44745-29-1
Synonyms: 2-Heptanamine, (2S)-, (S)-2-aminoheptane, Tuaminoheptane, (+)-, (2S)-heptan-2-amine, AC1MC1BF, UNII-1N3L0R99QB, 462632_ALDRICH, CTK1D5649, AKOS006240271, AG-A-07796, KB-04140, FT-0605250, I14-45950, 2-Heptanamine,(S)-;(+)-2-Aminoheptane;(+)-2-Heptylamine;(S)-(+)-2-Aminoheptane;(S)-2-Aminoheptane;(S)-2-Heptanamine;(S)-2-Heptylamine;d-2-Aminoheptane;

Molecular Formula: C7H17NMolecular Weight: 115.216580 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 1

InChIKey: VSRBKQFNFZQRBM-ZETCQYMHSA-N

• 2-Bromopentane
IUPAC Name: 2-bromopentane | CAS Registry Number: 107-81-3
Synonyms: Pentane, 2-bromo-, 2-BROMOPENTANE, 2-Pentyl bromide, ()-2-Bromopentane, ()-2-Pentyl bromide, B75204_ALDRICH, NSC7896, NSC 7896, EINECS 203-521-3, CID7890, UN2343, WLN: EY3 & 1, BRN 1718829, LS-101547, 2-Bromopentane [UN2343] [Flammable liquid], 2-Bromopentane [UN2343] [Flammable liquid], 4-01-00-00312 (Beilstein Handbook Reference), 130321-66-3

Molecular Formula: C5H11BrMolecular Weight: 151.044840 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 0

InChIKey: LGAJYTCRJPCZRJ-UHFFFAOYSA-N

• 2',3',4'-Trichloroacetophenone
IUPAC Name: 1-(2,3,4-trichlorophenyl)ethanone | CAS Registry Number: 13608-87-2
Synonyms: CCRIS 785, 2',3',4'-TRICHLOROACETOPHENONE, 178381_ALDRICH, EINECS 237-092-9, 1-(2,3,4-Trichlorophenyl)ethanone, Acetophenone, 2',3',4'-trichloro-, Ethanone, 1-(2,3,4-trichlorophenyl)-, LS-796, ZINC00056484, NCGC00091193-01, ST5308555, TL8000838

Molecular Formula: C8H5Cl3OMolecular Weight: 223.483700 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 1

InChIKey: BXJZZJYNVIDEKG-UHFFFAOYSA-N

• 2-Chloro-5-methylphenol
IUPAC Name: 2-chloro-5-methylphenol | CAS Registry Number: 615-74-7
Synonyms: 6-Chloro-m-cresol, m-Cresol, 6-chloro-, Phenol, 2-chloro-5-methyl-, 3-Methyl-6-chlorophenol, 5-Methyl-2-chlorophenol, 6-Chloro-3-methylphenol, CHLORO-M-CRESOL, Ambap5773, 4-Chloro-3-hydroxytoluene, 2-CHLORO-5-METHYLPHENOL, 2-CHLOROMETHYLPHENOL, Chloro-m-cresol, all isomers, HSDB 7107, 159557_ALDRICH, Chloro-m-toluidine, all isomers, 3-Methylphenol monochloro deriv., EINECS 210-444-9, BRN 2041487, ZINC00388375, Phenol, 3-methyl-, monochloro deriv.

Molecular Formula: C7H7ClOMolecular Weight: 142.582880 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 1

InChIKey: SMFHPCZZAAMJJO-UHFFFAOYSA-N

• 2,6-Difluorobenzaldehyde
IUPAC Name: 2,6-difluorobenzaldehyde | CAS Registry Number: 437-81-0
Synonyms: 265152_ALDRICH, JRD-0120, SBB006685, ZINC02539337, TL806242

Molecular Formula: C7H4F2OMolecular Weight: 142.102866 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 3

InChIKey: SOWRUJSGHKNOKN-UHFFFAOYSA-N

• 2,4-Difluorobenzamide
IUPAC Name: 2,4-difluorobenzamide | CAS Registry Number: 85118-02-1
Synonyms: Benzamide, 2,4-difluoro-, 566373_ALDRICH, ZINC00167180, EINECS 285-654-7, CID123588

Molecular Formula: C7H5F2NOMolecular Weight: 157.117506 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 3

InChIKey: KTXFXDMDYZIXSJ-UHFFFAOYSA-N

• 3-Acetylpyridine
IUPAC Name: 1-pyridin-3-ylethanone | CAS Registry Number: 350-03-8
Synonyms: 3-Acetopyridine, 3-ACETYLPYRIDINE, beta-Acetylpyridine, Methyl pyridyl ketone, Ketone, methyl 3-pyridyl, Methyl 3-pyridyl ketone, Pyridine, 3-acetyl-, 3-Pyridyl methyl ketone, Ethanone, 1-(3-pyridinyl)-, 1-(3-Pyridinyl)ethanone, .beta.-Acetylpyridine, 1-(3-Pyridenyl)ethanone, 1-pyridin-3-ylethanone, PYRIDINE,3-ACETYL, C7H7NO, FEMA No. 3424, WLN: T6NJ CV1, NCIOpen2_001469, A21207_ALDRICH, Methyl .beta.-pyridyl ketone

Molecular Formula: C7H7NOMolecular Weight: 121.136580 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 2

InChIKey: WEGYGNROSJDEIW-UHFFFAOYSA-N

• 2,4-difluorobenzoic acid
IUPAC Name: 2,4-difluorobenzoic acid | CAS Registry Number: 1583-58-0
Synonyms: 2,4-Difluorobenzoic acid, Ambap1792, 2,4-Difluoro-benzoic acid, Benzoic acid, 2,4-difluoro-, 2,4-DIFLUOROBENZOATE, 264296_ALDRICH, NSC10312, CID74102, JRD-0116, EINECS 216-430-9, TL806420, InChI=1/C7H4F2O2/c8-4-1-2-5(7(10)11)6(9)3-4/h1-3H,(H,10,11

Molecular Formula: C7H4F2O2Molecular Weight: 158.102266 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 4

InChIKey: NJYBIFYEWYWYAN-UHFFFAOYSA-N

• 2-Bromoacetophenone
IUPAC Name: 2-bromo-1-phenylethanone | CAS Registry Number: 70-11-1
Synonyms: Phenacyl bromide, Bromoacetophenone, Stauffer 4644, Acetophenone, 2-bromo-, omega-Bromoacetophenone, Bromomethyl phenyl ketone, omega-Bromacetophenone, 2-Bromo-1-phenylethanone, Ethanone, 2-bromo-1-phenyl-, .omega.-Bromacetophenone, .alpha.-Bromoacetophenone, .omega.-Bromoacetophenone, ALPHA-BROMOACETOPHENONE, CCRIS 6892, 115835_ALDRICH, NSC 9807, 77450_FLUKA, 77452_FLUKA, Acetophenone, 2-bromo- (8CI), CHEBI:51846

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

InChIKey: LIGACIXOYTUXAW-UHFFFAOYSA-N

• 2,6-Dimethoxy Phenol
IUPAC Name: 2,6-dimethoxyphenol | CAS Registry Number: 91-10-1
Synonyms: Syringol, Aldrich, 2,6-DIMETHOXYPHENOL, Pyrogallol 1,3-dimethyl ether, Phenol, 2,6-dimethoxy-, Pyrogallol dimethylether, 1,3-Dimethyl pyrogallate, 1,3-Di-o-methylpyrogallol, Ambap3610, 1,3-Dimethoxy-2-hydroxybenzene, 2-Hydroxy-1,3-dimethoxybenzene, FEMA No. 3137, 2,6-Dwumetoksyfenol [Polish], CHEBI:955, D135550_ALDRICH, W313718_ALDRICH, 38772_FLUKA, EINECS 202-041-1, CID7041, ZINC00154666

Molecular Formula: C8H10O3Molecular Weight: 154.163200 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 3

InChIKey: KLIDCXVFHGNTTM-UHFFFAOYSA-N

• 2,4-Diaminopyrimidine (2,4-DAP)
IUPAC Name: pyrimidine-2,4-diamine | CAS Registry Number: 156-81-0
Synonyms: 2,4-Diaminopyrimidine, 2,4-Pyrimidinediamine, Pyrimidine, 2,4-diamino-, Pyrimidine-2,4-diyldiamine, WLN: T6N CNJ BZ DZ, 2,4-Pyrimidinediamine (9CI), 468231_ALDRICH, PYRIMIDINE-2,4-DIAMINE, ZINC01661391, AIDS161816, AIDS-161816, CID67431, NSC30856, EINECS 205-862-3, NSC 30856, InChI=1/C4H6N4/c5-3-1-2-7-4(6)8-3/h1-2H,(H4,5,6,7,8, LG3

Molecular Formula: C4H6N4Molecular Weight: 110.117240 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 4

InChIKey: YAAWASYJIRZXSZ-UHFFFAOYSA-N

• 2-Hydroxy-6-Piocoline
IUPAC Name: 6-methyl-1H-pyridin-2-one | CAS Registry Number: 3279-76-3
Synonyms: 6-Methyl-2-pyridinol, 6-Methyl-2-pyridone, 2-Methyl-6-pyridone, 6-Hydroxy-2-picoline, 6-Methylpyridin-2-ol, 6-Methyl-2-pyridinone, 2-Pyridinol,6-methyl-, 2(1H)-Pyridone, 6-methyl-, 2-Hydroxy-6-methylpyridine, 6-Methyl-2-hydroxypyridine, NCIOpen2_000737, 6-methylpyridin-2(1H)-one, 128740_ALDRICH, NSC75619, 2(1H)-Pyridinone, 6-methyl-, 55768_FLUKA, CID76772, EINECS 221-919-5, NSC176166, SBB004345

Molecular Formula: C6H7NOMolecular Weight: 109.125880 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 1

InChIKey: JEAVIRYCMBDJIU-UHFFFAOYSA-N

• 1-Bromo-3-chloro-5,5-dimethyl Hydantoin
IUPAC Name: 1-bromo-3-chloro-5,5-dimethylimidazolidine-2,4-dione | CAS Registry Number: 16079-88-2
Synonyms: Agribrom, di-Halo, Slimicide 78P, Slimicide C 77P, Halogene T 30, Caswell No. 114A, Ambap3442, EINECS 240-230-0, EPA Pesticide Chemical Code 006315, CID61828, 1-Bromo-3-chloro-5,5-dimethylhydantoin, ZINC01850613, N-Bromo-N'-chloro-5,5-dimethylhydantoin, Hydantoin, 1-bromo-3-chloro-5,5-dimethyl-, LS-76013, 1-Bromo-3-chloro-5,5-dimethyl hydantoin, 1-Bromo-3-chloro-5,5-dimethyl-2,4-imidazolidinedione, 2,4-Imidazolidinedione, 1-bromo-3-chloro-5,5-dimethyl-, 1-BROMO-3-CHLORO-5,5-DIMETHYLIMIDAZOLIDINE-2,4-DIONE

Molecular Formula: C5H6BrClN2O2Molecular Weight: 241.470340 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 2

InChIKey: PIEXCQIOSMOEOU-UHFFFAOYSA-N

• (1S,2R)-2-Amino-1,2-diphenylethanol
IUPAC Name: [(1R,2S)-2-hydroxy-1,2-di(phenyl)ethyl]azanium | CAS Registry Number: 23364-44-5
Synonyms: ZINC00120672

Molecular Formula: C14H16NO+Molecular Weight: 214.282940 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 1

InChIKey: GEJJWYZZKKKSEV-KGLIPLIRSA-O

• (R)-3-Hydroxypyrrolidine
IUPAC Name: (3R)-pyrrolidin-1-ium-3-ol | CAS Registry Number: 2799-21-5
Synonyms: ZINC02140994, CID6992365

Molecular Formula: C4H10NO+Molecular Weight: 88.128300 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 1

InChIKey: JHHZLHWJQPUNKB-SCSAIBSYSA-O

• 2,3,4-Trifluorophenol
IUPAC Name: 2,3,4-trifluorophenol | CAS Registry Number: 2822-41-5
Synonyms: Phenol,2,3,4-trifluoro-, Phenol, 2,3,4-trifluoro-, 337285_ALDRICH, JRD-0382, ZINC00389597

Molecular Formula: C6H3F3OMolecular Weight: 148.082630 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 4

InChIKey: IJGSULQFKYOYEU-UHFFFAOYSA-N

• 5-Mercapto-1,2,3-triazole Monosodium Salt
IUPAC Name: 2H-triazole-4-thiolate | CAS Registry Number: 59032-27-8
Synonyms: 1H-1,2,3-triazole-5-thiol, ZINC04086148, CID6412704, AO-090/25092001

Molecular Formula: C2H2N3S-Molecular Weight: 100.122380 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 4

InChIKey: LLCOQBODWBFTDD-UHFFFAOYSA-M

• 1-Amino-4-cyclopentylpiperazine
IUPAC Name: 4-cyclopentylpiperazin-1-amine | CAS Registry Number: 61379-64-4
Synonyms: 4-Cyclopentylpiperazin-1-amine, EINECS 262-742-3, CID1512485, SL-00566

Molecular Formula: C9H19N3Molecular Weight: 169.267260 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 3

InChIKey: QYHRIASMJNLWHJ-UHFFFAOYSA-N


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