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• 4,4'-Dinitrobibenzyl
IUPAC Name: 1-nitro-4-[2-(4-nitrophenyl)ethyl]benzene | CAS Registry Number: 736-30-1
Synonyms: 4,4'-Dinitrodibenzyl, p,p'-Dinitrobibenzyl, p,p'-Dinitrodibenzyl, Bibenzyl, 4,4'-dinitro-, 1,2-Bis(4-nitrophenyl)ethane, 1,2-Bis(p-nitrophenyl)ethane, Dinitro-4,4' dibenzyle, NSC 608, NCIOpen2_002512, Dinitro-4,4' dibenzyle [French], NSC608, 1,2-Ethanediylbis(4-nitrobenzene), EINECS 212-001-5, NSC 60022, 1,2-Ethanediylbis[4-nitrobenzene], CID69776, NSC60022, Bibenzyl, 4,4'-dinitro- (8CI), STK005038, ZINC01596369

Molecular Formula: C14H12N2O4Molecular Weight: 272.256080 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 4

InChIKey: BSNKHEKTRWNNAC-UHFFFAOYSA-N

• 1-Nitroanthraquinone
IUPAC Name: 1-nitroanthracene-9,10-dione | CAS Registry Number: 82-34-8
Synonyms: 1-Nitroanthrachinon, 1-NITROANTHRAQUINONE, Anthraquinone, 1-nitro-, alpha-Nitroanthraquinone, 1-Nitro-anthraquinone, 1-Nitroanthrachinon [Czech], .alpha.-Nitroanthraquinone, 9,10-Anthracenedione, 1-nitro-, 1-nitroanthra-9,10-quinone, EINECS 201-413-0, CID6704, NSC 12125, NSC12125, WLN: L C666 BV IVJ DNW, ZINC03850744, BAS 00337029, LS-20706

Molecular Formula: C14H7NO4Molecular Weight: 253.209680 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 4

InChIKey: YCANAXVBJKNANM-UHFFFAOYSA-N

• (Dl)-2-Amino-1-Butanol
IUPAC Name: 2-aminobutan-1-ol | CAS Registry Number: 13054-87-0
Synonyms: 2-Amino-1-butanol, Butanol-2-amine, 2-Aminobutanol, 2-Aminobutan-1-ol, 2-Aminobutyl alcohol, 1-(Hydroxymethyl)propylamine, 1-Hydroxy-2-butylamine, 2-Amino-1-hydroxybutane, (-)-2-Aminobutanol, 1-BUTANOL, 2-AMINO-, 2-Amino-n-butyl alcohol, R(-)-2-Amino-1-butanol, ()-2-Amino-1-butanol, (R)-2-Aminobutan-1-ol, (+)-2-Amino-1-butanol, .+/-.-2-Amino-1-butanol, Oprea1_102773, A43804_ALDRICH, WLN: ZY2&1Q, 1-Butanol, 2-amino-, (S)-

Molecular Formula: C4H11NOMolecular Weight: 89.136240 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 2

InChIKey: JCBPETKZIGVZRE-UHFFFAOYSA-N

• 1,2-Dimethylindole
IUPAC Name: 1,2-dimethylindole | CAS Registry Number: 875-79-6
Synonyms: Indole, 1,2-dimethyl-, N-Methyl-2-methylindole, 1,2-DIMETHYLINDOLE, 1,2-Dimethyl-1H-indole, 1H-Indole, 1,2-dimethyl-, D165603_ALDRICH, Indole, 1,2-dimethyl- (8CI), NSC62087, EINECS 212-877-9, NSC 62087, STK301478, ZINC01081266, 1H-Indole, 1,2-dimethyl- (9CI), D-5348, InChI=1/C10H11N/c1-8-7-9-5-3-4-6-10(9)11(8)2/h3-7H,1-2H

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

InChIKey: BJMUOUXGBFNLSN-UHFFFAOYSA-N

• 1,3,3-Trimethyl-2-Methylene Indoline (Fischer's Base)
IUPAC Name: 1,3,3-trimethyl-2-methylideneindole | CAS Registry Number: 118-12-7
Synonyms: Fischer base, Fischer's base, Fischers Base, Fischer's methylene base, 1,3,3-Trimethyl-2-methyleneindoline, CCRIS 6608, 2-Methylene-1,3,3-trimethylindoline, M46209_ALDRICH, STOCK4S-26080, 92550_FLUKA, EINECS 204-235-1, NSC 66176, Indoline, 1,3,3-trimethyl-2-methylene-, Indoline, 2-methylene-1,3,3-trimethyl-, NSC66176, BRN 0131162, ZINC01693226, 1H-Indole, 2,3-dihydro-1,3,3-trimethyl-2-methylene-, LS-83461, ST5405757

Molecular Formula: C12H15NMolecular Weight: 173.254200 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 1

InChIKey: ZTUKGBOUHWYFGC-UHFFFAOYSA-N

• 1,4-Diamino Anthraquinone
IUPAC Name: 1,4-diaminoanthracene-9,10-dione | CAS Registry Number: 128-95-0
Synonyms: Krisolamine, Grasol Violet R, Seacyl Violet R, Setacyl Violet R, Oil Violet R, Acetate Red Violet R, Disperse Violet K, Disperse violet 1, Gracet Violet 2R, Oracet Violet 2R, Resiren Violet TR, Setile Violet 3R, Cibacet Violet 2R, Duranol Violet 2R, Nacelan Violet 4R, Amacel heliotrope R, Dispersive Violet K, Cibacete Violet 2R, Perliton Violet 3R, Solvent Violet 11

Molecular Formula: C14H10N2O2Molecular Weight: 238.241400 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 4

InChIKey: FBMQNRKSAWNXBT-UHFFFAOYSA-N

• 1,8-Naphthalic Anhydride
Synonyms: Protect, Pakarli, 1,8-Naphthalic anhydride, Naphthalic anhydride, Naphthalic acid anhydride, Protect (agrochemical), 1,8-Naphthalic acid anhydride, N1607_ALDRICH, Naphthalic anhydride (7CI,8CI), NSC 5747, 70320_FLUKA, EINECS 201-380-2, HSDB 7371, 1H,3H-Naphtho[1,8-cd]pyran-1,3-dione, NSC5747, WLN: T666 1A M CVOVJ, Naphthalene-1,8-dicarboxylic anhydride, 1,8-Naphthalenedicarboxylic acid anhydride, 1H,3H-Benzo[de]isochromene-1,3-dione, BRN 0153190

Molecular Formula: C12H6O3Molecular Weight: 198.174240 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 3

InChIKey: GRSMWKLPSNHDHA-UHFFFAOYSA-N

• 1-Acetonaphthone
IUPAC Name: 1-naphthalen-1-ylethanone | CAS Registry Number: 941-98-0
Synonyms: 1'-Acetonaphthone, 1-Acetylnaphthalene, 1-Acetonaphthalene, alpha-Acetonaphthone, Methyl 1-naphthyl ketone, alpha-Acetylnaphthalene, 1-Naphthyl methyl ketone, .alpha.-Acetonaphthone, alpha-Naphthyl methyl ketone, 1-(1-Naphthalenyl)ethanone, Ethanone, 1-(1-naphthalenyl)-, Methyl alpha-naphthyl ketone, .alpha.-Acetylnaphthalene, 1-(1-Naphthyl)ethanone, ALPHA-NAPHTHYLKETONE, ghl.PD_Mitscher_leg0.724, .alpha.-Naphthyl methyl ketone, Methyl .alpha.-naphthyl ketone, 276766_ALDRICH, NSC 7659

Molecular Formula: C12H10OMolecular Weight: 170.207200 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 1

InChIKey: QQLIGMASAVJVON-UHFFFAOYSA-N

• 1-Bromo 3 5-Difluorbenzene
IUPAC Name: 1-bromo-3,5-difluorobenzene | CAS Registry Number: 461-96-1
Synonyms: 1-Bromo-3,5-difluorobenzene, 290165_ALDRICH, ZINC00164583, JRD-0215, CID136313, ST5405331, TL8003201, InChI=1/C6H3BrF2/c7-4-1-5(8)3-6(9)2-4/h1-3

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

InChIKey: JHLKSIOJYMGSMB-UHFFFAOYSA-N

• 1-Bromo-4-Chlorobutane
IUPAC Name: 1-bromo-4-chlorobutane | CAS Registry Number: 6940-78-9
Synonyms: 1-Bromo-4-chlorobutane, Tetramethylene chlorobromide, Butane, 1-bromo-4-chloro-, 1-Chloro-4-bromobutane, 4-Bromo-1-chlorobutane, B60800_ALDRICH, NSC60193, EINECS 230-089-3, NSC 60193, TL8004863, InChI=1/C4H8BrCl/c5-3-1-2-4-6/h1-4H

Molecular Formula: C4H8BrClMolecular Weight: 171.463320 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 0

InChIKey: NIDSRGCVYOEDFW-UHFFFAOYSA-N

• 1-Naphthaldehyde
IUPAC Name: naphthalene-1-carbaldehyde | CAS Registry Number: 66-77-3
Synonyms: alpha-Naphthal, 1-Formylnaphthalene, 1-Naphthylaldehyde, Naphthaldehyde, alpha-Naphthaldehyde, I-Napthaldehyde, .alpha.-Naphthal, alpha-Naphthylaldehyde, 1-NAPHTHALENECARBOXALDEHYDE, .alpha.-Naphthaldehyde, alpha-Naphthylcarboxaldehyde, .alpha.-Naphthylaldehyde, N109_ALDRICH, .alpha.-Naphthylcarboxaldehyde, 1-NAPHTHALDEHYDE, REAG, NAPHTHALENECARBOXALDEHYDE, NSC 6106, 70180_FLUKA, EINECS 200-633-4, NSC6106

Molecular Formula: C11H8OMolecular Weight: 156.180620 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 1

InChIKey: SQAINHDHICKHLX-UHFFFAOYSA-N

• 2,2,2-Trifluoroethanol
IUPAC Name: 2,2,2-trifluoroethanol | CAS Registry Number: 75-89-8
Synonyms: Trifluoroethanol, Fluorinol 85, Ethanol, 2,2,2-trifluoro-, 2,2,2-TRIFLUOROETHANOL, Trifluoroethyl alcohol, 2,2,2-Trifluoroethyl alcohol, Alcohol, Trifluoroethyl, CF3CH2OH, WLN: Q1XFFF, Perfluoro-1,1-dihydroethanol, T63002_ALDRICH, NSC 451, beta,beta,beta-Trifluoroethyl alcohol, NSC451, 91683_FLUKA, 96924_FLUKA, CHEBI:42330, EINECS 200-913-6, ETHANOL,2,2,2-TRIFLUORO, 326747_SIAL

Molecular Formula: C2H3F3OMolecular Weight: 100.039830 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 4

InChIKey: RHQDFWAXVIIEBN-UHFFFAOYSA-N

• 2,3,4,5-Tetrafluoro-6-Nitrobenzoic Acid
IUPAC Name: 2,3,4,5-tetrafluoro-6-nitrobenzoate | CAS Registry Number: 16583-08-7
Synonyms: ZINC02389360, CID7010299

Molecular Formula: C7F4NO4-Molecular Weight: 238.072813 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 8

InChIKey: JQGBMYKEWLSLCI-UHFFFAOYSA-M

• 2',3'-Dideoxycytidine
IUPAC Name: 4-amino-1-[(2R,5S)-5-(hydroxymethyl)oxolan-2-yl]pyrimidin-2-one | CAS Registry Number: 7481-89-2
Synonyms: zalcitabine, Dideoxycytidine, ddCyd, Zalcitibine, HIVID, 2',3'-DIDEOXYCYTIDINE, ddC (Antiviral), Hivid (TN), PC-SOD+ddC, ddC & IFN.alpha., .beta.-D-DDC, Interferon AD + ddC, ddC & sCD4, ddC & GM-CSF, Prestwick0_001037, Prestwick1_001037, Prestwick2_001037, Prestwick3_001037, ddC & Interferon.alpha., CCRIS 692

Molecular Formula: C9H13N3O3Molecular Weight: 211.217820 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 4

InChIKey: WREGKURFCTUGRC-POYBYMJQSA-N

• 2,4,5-Trichloroaniline
IUPAC Name: 2,4,5-trichloroaniline | CAS Registry Number: 636-30-6
Synonyms: 2,4,5-TRICHLOROANILINE, Aniline, 2,4,5-trichloro-, Benzenamine, 2,4,5-trichloro-, T54003_ALDRICH, 35828_RIEDEL, CCRIS 2882, NSC64139, 91140_FLUKA, CID12487, EINECS 211-254-9, NSC 64139, SBB003585, ZINC00391971, Aniline, 2,4,5-trichloro- (8CI), TL8004450, InChI=1/C6H4Cl3N/c7-3-1-5(9)6(10)2-4(3)8/h1-2H,10H

Molecular Formula: C6H4Cl3NMolecular Weight: 196.461660 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 1

InChIKey: GUMCAKKKNKYFEB-UHFFFAOYSA-N

• 2,4-Dichloro Acetophenone
IUPAC Name: 1-(2,4-dichlorophenyl)ethanone | CAS Registry Number: 2234-16-4
Synonyms: 2',4'-Dichloroacetophenone, p-Chloro-2-chloroacetophenone, Acetophenone, 2',4'-dichloro-, 2,4-Dichloroacetophenone, Ethanone, 1-(2,4-dichlorophenyl)-, 1-(2,4-Dichlorophenyl)ethanone, 178373_ALDRICH, EINECS 218-780-8, 1-(2,4-Dichlorophenyl)ethan-1-one, NSC 33945, NSC33945, ZINC01665976, Acetophenone, 2',4'-dichloro- (8CI), 1-(2,4-DICHLOROPHENYL) ETHANONE, LS-184920, ST5213424, InChI=1/C8H6Cl2O/c1-5(11)7-3-2-6(9)4-8(7)10/h2-4H,1H

Molecular Formula: C8H6Cl2OMolecular Weight: 189.038640 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 1

InChIKey: XMCRWEBERCXJCH-UHFFFAOYSA-N

• 2,4-Dichlorobenzaldehyde
IUPAC Name: 2,4-dichlorobenzaldehyde | CAS Registry Number: 874-42-0
Synonyms: 2,4-DICHLOROBENZALDEHYDE, Benzaldehyde, 2,4-dichloro-, CCRIS 6013, 146757_ALDRICH, NSC 8762, 35250_FLUKA, EINECS 212-861-1, NSC8762, ZINC00478344, AI3-16063, LS-1876, NCGC00091704-01, ST5213382, AH-034/32850055, InChI=1/C7H4Cl2O/c8-6-2-1-5(4-10)7(9)3-6/h1-4

Molecular Formula: C7H4Cl2OMolecular Weight: 175.012060 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 1

InChIKey: YSFBEAASFUWWHU-UHFFFAOYSA-N

• 2,5-Diaminobenzene Sulphonic Acid
IUPAC Name: 2,5-diaminobenzenesulfonic acid | CAS Registry Number: 88-45-9
Synonyms: 2-Sulfo-p-phenylenediamine, 2,5-Diaminobenzenesulfonic acid, p-Phenylenediaminesulfonic acid, 2,5-Diaminobenzene sulfonic acid, CCRIS 2884, 2,5-Diaminobenzenesulphonic acid, Benzenesulfonic acid, 2,5-diamino-, 32776_FLUKA, EINECS 201-832-9, BRN 2970398, LS-31841, ST5436989, 4-14-00-02771 (Beilstein Handbook Reference), 77847-12-2

Molecular Formula: C6H8N2O3SMolecular Weight: 188.204320 [g/mol]
H-Bond Donor: 3H-Bond Acceptor: 5

InChIKey: HEAHMJLHQCESBZ-UHFFFAOYSA-N

• 2,5-Dichlorobenzaldehyde
IUPAC Name: 2,5-dichlorobenzaldehyde | CAS Registry Number: 6361-23-5
Synonyms: 523917_ALDRICH, ZINC02530965, CID80702, EINECS 228-832-1, SBB003793

Molecular Formula: C7H4Cl2OMolecular Weight: 175.012060 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 1

InChIKey: BUXHYMZMVMNDMG-UHFFFAOYSA-N

• 2-Aminothiophenol
IUPAC Name: 2-aminobenzenethiol | CAS Registry Number: 137-07-5
Synonyms: o-Mercaptoaniline, 2-Mercaptoaniline, o-Aminothiophenol, 2-Mercaptaniline, o-Aminobenzenethiol, Benzenethiol, 2-amino-, 2-AMINOBENZENETHIOL, Benzenethiol, o-amino-, 2-Amino thiophenol, 1-Amino-2-mercaptobenzene, o-Aminophenyl mercaptan, 2-Aminophenyl mercaptan, USAF EK-4376, WLN: ZR BSH, 123137_ALDRICH, 274240_ALDRICH, CCRIS 9096, NSC 4738, EINECS 205-277-3, CID8713

Molecular Formula: C6H7NSMolecular Weight: 125.191480 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 1

InChIKey: VRVRGVPWCUEOGV-UHFFFAOYSA-N

• 2-Bromo Propionic Acid
IUPAC Name: 2-bromopropanoic acid | CAS Registry Number: 598-72-1
Synonyms: 2-Bromopropanoic acid, Propanoic acid, 2-bromo-, 2-BROMOPROPIONIC ACID, Propionic acid, 2-bromo-, alpha-Bromopropionic acid, .alpha.-Bromopropionic acid, WLN: QVYE1, ()-2-Bromopropionic acid, NCIOpen2_009509, B78300_ALDRICH, NSC 172, (+/-)-2-Bromopropionic acid, 442337_SUPELCO, NSC172, 18170_FLUKA, EINECS 209-947-6, AI3-52314, Propionic acid, 2-bromo- (6CI,7CI,8CI), Propanoic acid, 2-bromo-, (.+/-.)-, LS-121233

Molecular Formula: C3H5BrO2Molecular Weight: 152.974600 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 2

InChIKey: MONMFXREYOKQTI-UHFFFAOYSA-N

• 2-Chlorobenzyl Chloride
IUPAC Name: 1-chloro-2-(chloromethyl)benzene | CAS Registry Number: 611-19-8
Synonyms: 2-Chlorobenzyl chloride, o-Chlorobenzyl chloride, alpha,2-Dichlorotoluene, alpha,o-Dichlorotoluene, ar,alpha-Dichlorotoluene, Ortho-alpha-dichlorotoluene, Toluene, o,alpha-dichloro-, Toluene, o,.alpha.-dichloro-, Benzene, 1-chloro-2-(chloromethyl)-, Toluene, ar,alpha-dichloro-, .alpha.,o-Dichlorotoluene, 1-Chloro-2-(chloromethyl)benzene, o,.alpha.-Dichlorotoluene, .alpha.,2-Dichlorotoluene, Toluene, alpha,o-dichloro-, Benzene, chloro(chloromethyl)-, Ortho-.alpha.-dichlorotoluene, 194255_ALDRICH, 241180_ALDRICH, NSC 8446

Molecular Formula: C7H6Cl2Molecular Weight: 161.028540 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 0

InChIKey: BASMANVIUSSIIM-UHFFFAOYSA-N

• 2-Fluorobenzoyl Chloride
IUPAC Name: 2-fluorobenzoyl chloride | CAS Registry Number: 393-52-2
Synonyms: o-Fluorobenzoyl chloride, 2-FLUOROBENZOYL CHLORIDE, Benzoyl chloride, 2-fluoro-, Benzoyl chloride, o-fluoro-, WLN: GVR BF, CCRIS 5914, HSDB 4261, 120847_ALDRICH, 46740_FLUKA, EINECS 206-887-2, NSC 88304, NSC88304, BRN 0636864, LS-107, ZINC02022413, NCGC00091418-01, F157, ST5214060, TL8002844, 4-09-00-00951 (Beilstein Handbook Reference)

Molecular Formula: C7H4ClFOMolecular Weight: 158.557463 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 2

InChIKey: RAAGZOYMEQDCTD-UHFFFAOYSA-N

• 3,4-Difluorobromobenzene
IUPAC Name: 4-bromo-1,2-difluorobenzene | CAS Registry Number: 348-61-8
Synonyms: 4-Bromo-1,2-difluorobenzene, 1-Bromo-3,4-difluorobenzene, 263478_ALDRICH, JRD-0308, NSC10251, EINECS 206-481-5, ZINC00164754, TL806160, ST5405344, InChI=1/C6H3BrF2/c7-4-1-2-5(8)6(9)3-4/h1-3

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

InChIKey: YMQPKONILWWJQG-UHFFFAOYSA-N

• 3,4-Methylene Dioxy Benzene
IUPAC Name: 1,3-benzodioxole | CAS Registry Number: 274-09-9
Synonyms: Benzodioxole, 1,3-BENZODIOXOLE, 1,3-Dioxaindan, 1,3-Dioxindan, Methylenedioxybenzene, 1,3-Benzodioxolane, 1,2-Methylenedioxybenzene, 2H-1,3-Benzodioxole, 3,4-Methylenedioxybenzene, o-Methylenedioxybenzene, o-(Methylenedioxy)benzene, (Methylenedioxy)benzene, 1,2-(Methylenedioxy)benzene, Benzene, 1,2-methylenedioxy-, Benzene, 1,2-(methylenedioxy)-, ghl.PD_Mitscher_leg0.1027, 159166_ALDRICH, WLN: T56 BO DO CHJ, CHEBI:38732, EINECS 205-992-0

Molecular Formula: C7H6O2Molecular Weight: 122.121340 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 2

InChIKey: FTNJQNQLEGKTGD-UHFFFAOYSA-N

• 2-Bromo-3-methylbutyric acid
IUPAC Name: 2-bromo-3-methylbutanoic acid | CAS Registry Number: 565-74-2
Synonyms: 2-Bromoisovaleric acid, alpha-Bromoisovaleric acid, 2-Bromo-3-methylbutanoic acid, Butyric acid, 2-bromo-3-methyl-, Butanoic acid, 2-bromo-3-methyl-, .alpha.-Bromoisovaleric acid, NSC 167, 251003_ALDRICH, NSC167, 17460_FLUKA, EINECS 209-291-0, NSC6967, BB_SC-0176, BRN 1721146, AI3-21065, 2-BROMO-3-METHYL-BUTANOIC ACID, LS-47883, (+/-)-2-BROMO-3-METHYLBUTYRIC ACID, Butanoic acid, 2-bromo-3-methyl-, (.+/-.)-, InChI=1/C5H9BrO2/c1-3(2)4(6)5(7)8/h3-4H,1-2H3,(H,7,8

Molecular Formula: C5H9BrO2Molecular Weight: 181.027760 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 2

InChIKey: UEBARDWJXBGYEJ-UHFFFAOYSA-N

• (S)-3-Chloro-1,2-propanediol
IUPAC Name: (2S)-3-chloropropane-1,2-diol | CAS Registry Number: 60827-45-4
Synonyms: alpha-Chlorohydrin, (S)-alpha-Chlorohydrin, sGPhMQDIK]UQX@, S-3-Chloro-1,2-propanediol, 3-Chloropropane-1,2-diol, CCRIS 7386, 1,2-Propanediol, 3-chloro-, 540064_ALDRICH, (S)-alpha-Glycerol chlorohydrin, 26077_FLUKA, 1,2-Propanediol, 3-chloro-, (S)-, ZINC02041174, (S)-()-3-Chloro-1,2-propanediol, (S)-(+)-3-Chloro-1,2-propanediol, LS-120253, TL8003855, InChI=1/C3H7ClO2/c4-1-3(6)2-5/h3,5-6H,1-2H, 96-24-2

Molecular Formula: C3H7ClO2Molecular Weight: 110.539480 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 2

InChIKey: SSZWWUDQMAHNAQ-GSVOUGTGSA-N

• 2,4-Dimethoxy-6-chloropyrimidine
IUPAC Name: 4-chloro-2,6-dimethoxypyrimidine | CAS Registry Number: 6320-15-6
Synonyms: C36408_ALDRICH, 6-Chloro-2,4-dimethoxypyrimidine, NSC31796, 4-Chloro-2,6-dimethoxypyrimidine, CID80600, EINECS 228-669-6, ZINC00399489, Pyrimidine, 4-chloro-2,6-dimethoxy-, ST5410866

Molecular Formula: C6H7ClN2O2Molecular Weight: 174.584980 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 4

InChIKey: JHNRTJRDRWKAIW-UHFFFAOYSA-N

• 2,5-Diamino-1,3-benzenedisulfonic acid
IUPAC Name: 2,5-diaminobenzene-1,3-disulfonic acid | CAS Registry Number: 6409-48-9
Synonyms: 2,5-diaminobenzene-1,3-disulfonic acid, 2,5-DIAMINO-1,3-BENZENEDISULFONIC ACID, AGN-PC-00OMHL, CTK2F2940, MolPort-005-942-899, AKOS015891341, AG-G-40158, p-Phenylenediamine-2,6-disulfonic acid, AK112360, 1,3-Benzenedisulfonicacid, 2,5-diamino-, 1,3-Benzenedisulfonic acid, 2,5-diamino-, KB-165213, 2,5-bis(azanyl)benzene-1,3-disulfonic acid, FT-0636139, A834638, I01-9820, m-Benzenedisulfonicacid, 2,5-diamino- (7CI,8CI); 1,4-Diamino-2,6-benzenedisulfonic acid;1,4-Phenylenediamine-2,6-disulfonic acid; 2,5-Diamino-1,3-benzenedisulfonicacid; p-Phenylenediamine-2,6-disulfonic acid

Molecular Formula: C6H8N2O6S2Molecular Weight: 268.267520 [g/mol]
H-Bond Donor: 4H-Bond Acceptor: 8

InChIKey: QGNJPFLIBOTDKU-UHFFFAOYSA-N

• 2,4,6-Trichlorobenzonitrile
IUPAC Name: 2,4,6-trichlorobenzonitrile | CAS Registry Number: 6575-05-9
Synonyms: ZINC00167063, CID522179, ST5406943

Molecular Formula: C7H2Cl3NMolecular Weight: 206.456480 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 1

InChIKey: PGODHCIOIPODFE-UHFFFAOYSA-N

• (1R,2R)-(-)-2-Amino-1-(4-nitrophenyl)-1,3-propanediol
IUPAC Name: (1R,2R)-2-amino-1-(4-nitrophenyl)propane-1,3-diol | CAS Registry Number: 716-61-0
Synonyms: Levoamine, Chloramphenicol base, A70704_ALDRICH, EINECS 211-938-7, LS-120138, TL8005023, D-(-)Threo-2-amino-1-(p-nitrophenyl)propane-1,3-diol, D-threo-(-)-2-Amino-1-(p-nitrophenyl)-1,3-propanediol, 1,3-Propanediol, 2-amino-1-(p-nitrophenyl)-, D-threo-(-)-, (1R,2R)-(−)-2-Amino-1-(4-nitrophenyl)-1,3-propanediol, D-(−)-threo-2-Amino-1-(p-nitrophenyl)-1,3-propanediol

Molecular Formula: C9H12N2O4Molecular Weight: 212.202580 [g/mol]
H-Bond Donor: 3H-Bond Acceptor: 5

InChIKey: OCYJXSUPZMNXEN-RKDXNWHRSA-N

• 1,2-dichloro-4,5-dinitro-benzene
IUPAC Name: 1,2-dichloro-4,5-dinitrobenzene | CAS Registry Number: 6306-39-4
Synonyms: Parazol, 1,2-Dichloro-4,5-dinitrobenzene, 1,2diCl4,5diNO2Ph, 4,5-Dichloro-1,2-dinitrobenzene, WLN: WNR CG DG FNW, Benzene, 1,2-dichloro-4,5-dinitro-, 300365_ALDRICH, NSC 22945, AIDS006011, AIDS-006011, CID80565, NSC22945, BRN 2460868, AI3-19504, LS-29796, 4-05-00-00747 (Beilstein Handbook Reference)

Molecular Formula: C6H2Cl2N2O4Molecular Weight: 236.997080 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 4

InChIKey: IGSAVPVCQHAPSM-UHFFFAOYSA-N

• 2-Bromo-4-Fluoroaniline
IUPAC Name: 2-bromo-4-fluoroaniline | CAS Registry Number: 1003-98-1
Synonyms: 2-Bromo-4-fluoroaniline, 2-Bromo-4-fluorobenzenamine, 369055_ALDRICH, NSC51870, CID242873, ZINC00159787, ST5408548, TL8000048

Molecular Formula: C6H5BrFNMolecular Weight: 190.013003 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 2

InChIKey: YLMFXCIATJJKQL-UHFFFAOYSA-N

• 2-Bromo-4-NitroToluene
IUPAC Name: 2-bromo-1-methyl-4-nitrobenzene | CAS Registry Number: 7745-93-9
Synonyms: 2-Bromo-4-nitrotoluene, B74402_ALDRICH, Toluene, 2-bromo-4-nitro-, 1-Bromo-2-methyl-5-nitrobenzene, 2-Bromo-1-methyl-4-nitrobenzene, Benzene, 2-bromo-1-methyl-4-nitro-, EINECS 231-809-9, NSC402166, SBB007843, ZINC01081254, FR-0441, TL80073548, AE-641/04636041

Molecular Formula: C7H6BrNO2Molecular Weight: 216.032040 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 2

InChIKey: XFZFJQHXWJIBQV-UHFFFAOYSA-N

• 2-Chloro-5-Nitro Benzoyl Chloride
IUPAC Name: 2-chloro-5-nitrobenzoyl chloride | CAS Registry Number: 25784-91-2
Synonyms: 2-Chloro-5-nitrobenzoyl chloride, Benzoyl chloride, 2-chloro-5-nitro-, ZINC02522758, EINECS 247-262-4, CID117637, InChI=1/C7H3Cl2NO3/c8-6-2-1-4(10(12)13)3-5(6)7(9)11/h1-3

Molecular Formula: C7H3Cl2NO3Molecular Weight: 220.009620 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 3

InChIKey: OGLKKYALUKXVPQ-UHFFFAOYSA-N

• 2-Cyanomethyl Benzimidazole
IUPAC Name: 2-(1H-benzimidazol-2-yl)acetonitrile | CAS Registry Number: 4414-88-4
Synonyms: 2-Benzimidazolylacetonitrile, 2-Cyanomethylbenzimidazole, 2-Kyanmethylbenzimidazol, 1H-Benzimidazole-2-acetonitrile, Enamine_003017, Benzimidazole, 2-cyanomethyl-, Acetonitrile, 2-benzimidazolyl-, (2-Benzimidazolyl)acetonitrile, 2-BENZIMIDAZOLEACETONITRILE, B5291_ALDRICH, 2-(Cyanomethyl)benzimidazole, Oprea1_467984, (Benzimidazol-2-yl)ethanenitrile, 2-Kyanmethylbenzimidazol [Czech], ARONIS020221, 12263_FLUKA, EINECS 224-574-9, ZERO/005566, 1H-Benzimidazol-2-ylacetonitrile, WLN: T56 BM DNJ C1CN

Molecular Formula: C9H7N3Molecular Weight: 157.171980 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 3

InChIKey: BWOVACANEIVHST-UHFFFAOYSA-N

• 2-Fluoro Benzaldehyde
IUPAC Name: 2-fluorobenzaldehyde | CAS Registry Number: 446-52-6
Synonyms: 2-Fluorobenzaldehyde, o-Fluorobenzaldehyde, Benzaldehyde, 2-fluoro-, Benzaldehyde, o-fluoro-, F4807_ALDRICH, Benzaldehyde, o-fluoro- (8CI), EINECS 207-171-2, NSC 66829, NSC66829, BRN 0507155, ZINC00157161, LS-25048, ST5213339, 4-07-00-00559 (Beilstein Handbook Reference), InChI=1/C7H5FO/c8-7-4-2-1-3-6(7)5-9/h1-5

Molecular Formula: C7H5FOMolecular Weight: 124.112403 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 2

InChIKey: ZWDVQMVZZYIAHO-UHFFFAOYSA-N

• 2-Methoxy-5-Sulfamoyl Benzoic Acid
IUPAC Name: 2-methoxy-5-sulfamoylbenzoic acid | CAS Registry Number: 22117-85-7
Synonyms: 5-Sulphamoyl-o-anisic acid, EINECS 244-789-1, ST5407390

Molecular Formula: C8H9NO5SMolecular Weight: 231.225760 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 6

InChIKey: SQAILWDRVDGLGY-UHFFFAOYSA-N

• 2-Oxindole
IUPAC Name: 1,3-dihydroindol-2-one | CAS Registry Number: 59-48-3
Synonyms: Oxindole, 2-Indolinone, Indolin-2-one, Oxindol, 2-Oxoindoline, 1,3-Dihydroindol-2-one, Indol-2(3H)-one, indolin-2(1H)-one, 1,3-Dihydro-2H-indol-2-one, O9808_ALDRICH, 2H-Indol-2-one, 1,3-dihydro-, 57260_FLUKA, CHEBI:31697, CPD-6361, NSC274863, SBB004215, ZINC00058282, TL806283, C12312, AH-034/32845032

Molecular Formula: C8H7NOMolecular Weight: 133.147280 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 1

InChIKey: JYGFTBXVXVMTGB-UHFFFAOYSA-N

• 3,5-Dichloro Bromo Benzene
IUPAC Name: 1-bromo-3,5-dichlorobenzene | CAS Registry Number: 19752-55-7
Synonyms: Maybridge1_000881, 1-BROMO-3,5-DICHLOROBENZENE, Benzene, 1-bromo-3,5-dichloro-, 277789_ALDRICH, EINECS 243-270-7, ST5405843, TL8001619, SR-01000640136-1, InChI=1/C6H3BrCl2/c7-4-1-5(8)3-6(9)2-4/h1-3

Molecular Formula: C6H3BrCl2Molecular Weight: 225.898020 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 0

InChIKey: DZHFFMWJXJBBRG-UHFFFAOYSA-N

• 2-H-Imidazole-1-carboxaldehyde
IUPAC Name: 1H-imidazole-2-carbaldehyde | CAS Registry Number: 10111-08-7
Synonyms: 2-Formylimidazole, Imidazole-2-carboxaldehyde, 1H-Imidazole-2-carbaldehyde, 1H-IMIDAZOLE-2-CARBOXALDEHYDE, 272000_ALDRICH, ALBB-006207, SBB004383, ZINC01069165, F2135G1

Molecular Formula: C4H4N2OMolecular Weight: 96.087360 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 3

InChIKey: XYHKNCXZYYTLRG-UHFFFAOYSA-N

• 2-Amino-6-Chlorobenzoic Acid
IUPAC Name: 2-amino-6-chlorobenzoic acid | CAS Registry Number: 2148-56-3
Synonyms: 6-Chloroanthranilic acid, 2-Amino-6-chlorobenzoic acid, 422622_ALDRICH, Benzoic acid, 2-amino-6-chloro-, ZERO/001505, NSC17189, EINECS 218-416-8, TL8001783, A-5352, InChI=1/C7H6ClNO2/c8-4-2-1-3-5(9)6(4)7(10)11/h1-3H,9H2,(H,10,11

Molecular Formula: C7H6ClNO2Molecular Weight: 171.581040 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 3

InChIKey: SZCPTRGBOVXVCA-UHFFFAOYSA-N

• 2-Bromochlorobenzene
IUPAC Name: 1-bromo-2-chlorobenzene | CAS Registry Number: 694-80-4
Synonyms: o-Bromochlorobenzene, 1-Bromo-2-chlorobenzene, Bromochlorobenzene, o-Chlorobromobenzene, 2-Chlorobromobenzene, Benzene, 1-bromo-2-chloro-, 1-Chloro-2-bromobenzene, 2-Bromo-1-chlorobenzene, 2-BROMOCHLOROBENZENE, B60401_ALDRICH, 442333_SUPELCO, NSC59694, EINECS 211-775-1, EINECS 249-303-1, NSC 59694, AI3-31290, ST5406321, TL8004873, InChI=1/C6H4BrCl/c7-5-3-1-2-4-6(5)8/h1-4, 28906-38-9

Molecular Formula: C6H4BrClMolecular Weight: 191.452960 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 0

InChIKey: QBELEDRHMPMKHP-UHFFFAOYSA-N

• 2-Bromo-1,3,5-trifluorobenzene
IUPAC Name: 2-bromo-1,3,5-trifluorobenzene | CAS Registry Number: 2367-76-2
Synonyms: 1-Bromo-2,4,6-trifluorobenzene, 2,4,6-Trifluorobromobenzene, 247987_ALDRICH, Benzene, 2-bromo-1,3,5-trifluoro-, CID75398, EINECS 219-125-9, TE3097, ST5408595, TL8001955, InChI=1/C6H2BrF3/c7-6-4(9)1-3(8)2-5(6)10/h1-2

Molecular Formula: C6H2BrF3Molecular Weight: 210.979290 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 3

InChIKey: PZBSPSOGEVCRQI-UHFFFAOYSA-N

• 2-Methoxy-3-ethylpyrazine
IUPAC Name: 2-ethyl-3-methoxypyrazine | CAS Registry Number: 25680-58-4
Synonyms: 2-ETHYL-3-METHOXYPYRAZINE, Pyrazine, 2-ethyl-3-methoxy-, W514403_ALDRICH, 293806_ALDRICH, EINECS 247-184-0, ZINC00409299, InChI=1/C7H10N2O/c1-3-6-7(10-2)9-5-4-8-6/h4-5H,3H2,1-2H

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

InChIKey: DPCILIMHENXHQX-UHFFFAOYSA-N

• 2-(2-Hydroxy-5-tert-octylphenyl)benzotriazole
IUPAC Name: 2-(benzotriazol-2-yl)-4-(2,4,4-trimethylpentan-2-yl)phenol | CAS Registry Number: 3147-75-9
Synonyms: OCTRIZOLE, UV Absorber-5, Sumisorb 340, Seesorb 709, Tinuvin 329, Viosorb 583, Cyasorb 5411, Cyasorb UV 5411, Octrizole [USAN:INN], Octrizol [INN-Spanish], Octrizolum [INN-Latin], Spectra-Sorb UV 5411, Octrizole (USAN/INN), Oprea1_301042, 322806_ALDRICH, 2-Benzotriazolyl-4-tert-octylphenol, EINECS 221-573-5, ZINC01849911, 2-(2-Hydroxy-5-t-octylphenyl)benzotriazole, 2-(5-t-Octyl-2-hydroxyphenyl)benzotriazole

Molecular Formula: C20H25N3OMolecular Weight: 323.432000 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 4

InChIKey: IYAZLDLPUNDVAG-UHFFFAOYSA-N

• 5-Bromo-2-fluorotoluene
IUPAC Name: 4-bromo-1-fluoro-2-methylbenzene | CAS Registry Number: 51437-00-4
Synonyms: 283495_ALDRICH, 17105_FLUKA, Benzene, 4-bromo-1-fluoro-2-methyl-, EINECS 257-202-9, ST5405489, TL8003405, InChI=1/C7H6BrF/c1-5-4-6(8)2-3-7(5)9/h2-4H,1H

Molecular Formula: C7H6BrFMolecular Weight: 189.024943 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 1

InChIKey: VXKYOKPNAXNAFU-UHFFFAOYSA-N

• 2,3-Dihydrofuran
IUPAC Name: 2,3-dihydrofuran | CAS Registry Number: 1191-99-7
Synonyms: 4,5-Dihydrofuran, Furan, 2,3-dihydro-, 200018_ALDRICH, CHEBI:51662, 2,3-DHF, ZINC01752336, CID70934, NSC85221, EINECS 214-747-7, NSC 85221, InChI=1/C4H6O/c1-2-4-5-3-1/h1,3H,2,4H, 27535-65-5, 36312-17-1

Molecular Formula: C4H6OMolecular Weight: 70.089840 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 1

InChIKey: JKTCBAGSMQIFNL-UHFFFAOYSA-N

• 2,5-Dihydroxy-1,4-dithiane
IUPAC Name: 1,4-dithiane-2,5-diol | CAS Registry Number: 40018-26-6
Synonyms: Dithian, 1,4-Dithiane-2,5-diol, p-Dithiane-2,5-diol, Mercaptoacetaldehyde dimer, 2,5-Dimethyl-1,4-dithiane, W382604_ALDRICH, 183954_ALDRICH, 10883_FLUKA, EINECS 254-751-6, NSC106280

Molecular Formula: C4H8O2S2Molecular Weight: 152.235120 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 2

InChIKey: YUIOPHXTILULQC-UHFFFAOYSA-N

• 2-(2-Hydroxyethyl)pyridine
IUPAC Name: 2-pyridin-2-ylethanol | CAS Registry Number: 103-74-2
Synonyms: Pyridine-2-ethanol, 2-PYRIDINEETHANOL, 2-Pyridylethanol, 2-(2-Pyridyl)ethanol, 2-pyridin-2-ylethanol, Ambap4520, 2-ETHANOLPYRIDINE, 2-(beta-Hydroxyethyl)pyridine, NCIOpen2_000827, HSDB 5357, 2-(2-Hydroxyethyl)-pyridine, Pyridine, 2-(2-hydroxyethyl)-, 128643_ALDRICH, NSC 2144, EINECS 203-140-2, NSC2144, AIDS020381, AIDS-020381, NSC77979, BRN 0111205

Molecular Formula: C7H9NOMolecular Weight: 123.152460 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 2

InChIKey: BXGYBSJAZFGIPX-UHFFFAOYSA-N


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