Sunday, August 4, 2013

All Chemical Compounds Information




Product OPENEYE NAME: cyclohexyltin(3+) chloride
CAS Name: cyclohexyltin(3+) chloride
IUPAC NAME: cyclohexyltin(3+) chloride
SYSTEMATIC NAME: cyclohexyltin(3+) chloride
MOLECULAR FORMULA: C6H11ClSn+2
MOLECULAR WEIGHT: 237.31454
SMILES: C1CCC(CC1)[Sn+3].[Cl-]
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Product OPENEYE NAME: cyclohexyltin(3+)
CAS Name: cyclohexyltin(3+)
IUPAC NAME: cyclohexyltin(3+)
SYSTEMATIC NAME: cyclohexyltin(3+)
MOLECULAR FORMULA: C6H11Sn+3
MOLECULAR WEIGHT: 201.86154
SMILES: C1CCC(CC1)[Sn+3]
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Product OPENEYE NAME: nickelous 1-(1-carbamothioylsulfanylcyclopropyl)ethyl carbamodithioate
CAS Name: carbamodithioic acid 1-[1-(carbamothioylthio)cyclopropyl]ethyl ester; nickel(2+)
IUPAC NAME: 1-(1-carbamothioylsulfanylcyclopropyl)ethyl carbamodithioate; nickel(2+)
SYSTEMATIC NAME: 1-(1-carbamothioylsulfanylcyclopropyl)ethyl carbamodithioate; nickel(2+)
MOLECULAR FORMULA: C7H12N2NiS4+2
MOLECULAR WEIGHT: 311.13698
SMILES: CC(C1(CC1)SC(=S)N)SC(=S)N.[Ni+2]
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Product OPENEYE NAME: 1-(1-carbamothioylsulfanylcyclopropyl)ethyl carbamodithioate
CAS Name: carbamodithioic acid 1-[1-(carbamothioylthio)cyclopropyl]ethyl ester
IUPAC NAME: 1-(1-carbamothioylsulfanylcyclopropyl)ethyl carbamodithioate
SYSTEMATIC NAME: 1-(1-carbamothioylsulfanylcyclopropyl)ethyl carbamodithioate
MOLECULAR FORMULA: C7H12N2S4
MOLECULAR WEIGHT: 252.44358
SMILES: CC(C1(CC1)SC(=S)N)SC(=S)N
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Product OPENEYE NAME: prop-2-enoate; vinyl butanoate
CAS Name: butanoic acid ethenyl ester; 2-propenoate
IUPAC NAME: ethenyl butanoate; prop-2-enoate
SYSTEMATIC NAME: ethenyl butanoate; prop-2-enoate
MOLECULAR FORMULA: C9H13O4-
MOLECULAR WEIGHT: 185.19712
SMILES: CCCC(=O)OC=C.C=CC(=O)[O-]
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Product OPENEYE NAME: potassium 2-carbamothioylsulfanylpropyl carbamodithioate
CAS Name: potassium carbamodithioic acid 2-(carbamothioylthio)propyl ester
IUPAC NAME: potassium 2-carbamothioylsulfanylpropyl carbamodithioate
SYSTEMATIC NAME: potassium 2-carbamothioylsulfanylpropyl carbamodithioate
MOLECULAR FORMULA: C5H10KN2S4+
MOLECULAR WEIGHT: 265.5046
SMILES: CC(CSC(=S)N)SC(=S)N.[K+]
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Product OPENEYE NAME: copper 8,8a-dihydroquinoline-2-carboxylate
CAS Name: copper 8,8a-dihydroquinoline-2-carboxylate
IUPAC NAME: copper 8,8a-dihydroquinoline-2-carboxylate
SYSTEMATIC NAME: copper 8,8a-dihydroquinoline-2-carboxylate
MOLECULAR FORMULA: C20H16CuN2O4
MOLECULAR WEIGHT: 411.89804
SMILES: C1C=CC=C2C1N=C(C=C2)C(=O)[O-].C1C=CC=C2C1N=C(C=C2)C(=O)[O-].[Cu+2]
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Product OPENEYE NAME: 8,8a-dihydroquinoline-2-carboxylic acid
CAS Name: 8,8a-dihydroquinoline-2-carboxylic acid
IUPAC NAME: 8,8a-dihydroquinoline-2-carboxylic acid
SYSTEMATIC NAME: 8,8a-dihydroquinoline-2-carboxylic acid
MOLECULAR FORMULA: C10H9NO2
MOLECULAR WEIGHT: 175.18396
SMILES: C1C=CC=C2C1N=C(C=C2)C(=O)O
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Product OPENEYE NAME: potassium 2-carbamothioylsulfanylethyl carbamodithioate
CAS Name: potassium carbamodithioic acid 2-(carbamothioylthio)ethyl ester
IUPAC NAME: potassium 2-carbamothioylsulfanylethyl carbamodithioate
SYSTEMATIC NAME: potassium 2-carbamothioylsulfanylethyl carbamodithioate
MOLECULAR FORMULA: C4H8KN2S4+
MOLECULAR WEIGHT: 251.47802
SMILES: C(CSC(=S)N)SC(=S)N.[K+]
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Product OPENEYE NAME: 1,2-dibutylcyclohexane
CAS Name: 1,2-dibutylcyclohexane
IUPAC NAME: 1,2-dibutylcyclohexane
SYSTEMATIC NAME: 1,2-dibutylcyclohexane
MOLECULAR FORMULA: C14H28
MOLECULAR WEIGHT: 196.37212
SMILES: CCCCC1CCCCC1CCCC
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Product OPENEYE NAME: 2-methylprop-2-eneperoxoic acid; prop-2-enoate
CAS Name: 2-methyl-2-propeneperoxoic acid; 2-propenoate
IUPAC NAME: 2-methylprop-2-eneperoxoic acid; prop-2-enoate
SYSTEMATIC NAME: 2-methylprop-2-eneperoxoic acid; prop-2-enoate
MOLECULAR FORMULA: C7H9O5-
MOLECULAR WEIGHT: 173.14336
SMILES: CC(=C)C(=O)OO.C=CC(=O)[O-]
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Product OPENEYE NAME: 1,1,2-triethoxyethoxy(vinyl)silicon
CAS Name: ethenyl(1,1,2-triethoxyethoxy)silicon
IUPAC NAME: ethenyl(1,1,2-triethoxyethoxy)silicon
SYSTEMATIC NAME: ethenyl(1,1,2-triethoxyethoxy)silicon
MOLECULAR FORMULA: C10H20O4Si
MOLECULAR WEIGHT: 232.3489
SMILES: CCOCC(OCC)(OCC)O[Si]C=C
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Product OPENEYE NAME: 1-butoxybutane; methoxymethane; urea
CAS Name: 1-butoxybutane; methoxymethane; urea
IUPAC NAME: 1-butoxybutane; methoxymethane; urea
SYSTEMATIC NAME: 1-butoxybutane; methoxymethane; urea
MOLECULAR FORMULA: C11H28N2O3
MOLECULAR WEIGHT: 236.35162
SMILES: CCCCOCCCC.COC.C(=O)(N)N
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Product OPENEYE NAME: [[4-[butoxymethyl(hydroxymethyl)amino]-6-phenyl-1,3,5-triazin-2-yl]-(hydroxymethyl)amino]methanol
CAS Name: [[4-[butoxymethyl(hydroxymethyl)amino]-6-phenyl-1,3,5-triazin-2-yl]-(hydroxymethyl)amino]methanol
IUPAC NAME: [[4-[butoxymethyl(hydroxymethyl)amino]-6-phenyl-1,3,5-triazin-2-yl]-(hydroxymethyl)amino]methanol
SYSTEMATIC NAME: [[4-[butoxymethyl(hydroxymethyl)amino]-6-phenyl-1,3,5-triazin-2-yl]-(hydroxymethyl)amino]methanol
MOLECULAR FORMULA: C17H25N5O4
MOLECULAR WEIGHT: 363.4115
SMILES: CCCCOCN(CO)C1=NC(=NC(=N1)N(CO)CO)C2=CC=CC=C2
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Product OPENEYE NAME: 2,5-bis(2,5-dimethylhexylperoxy)-2,5-dimethyl-hexane
CAS Name: 2,5-bis(2,5-dimethylhexyldioxy)-2,5-dimethylhexane
IUPAC NAME: 2,5-bis(2,5-dimethylhexylperoxy)-2,5-dimethylhexane
SYSTEMATIC NAME: 2,5-bis(2,5-dimethylhexylperoxy)-2,5-dimethyl-hexane
MOLECULAR FORMULA: C24H50O4
MOLECULAR WEIGHT: 402.6514
SMILES: CC(C)CCC(C)COOC(C)(C)CCC(C)(C)OOCC(C)CCC(C)C
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Product OPENEYE NAME: [2,5-bis(tert-butylperoxy)-2,5-dimethyl-6-phenyl-hexyl]benzene
CAS Name: [2,5-bis(tert-butyldioxy)-2,5-dimethyl-6-phenylhexyl]benzene
IUPAC NAME: [2,5-bis(tert-butylperoxy)-2,5-dimethyl-6-phenylhexyl]benzene
SYSTEMATIC NAME: [2,5-bis(tert-butylperoxy)-2,5-dimethyl-6-phenyl-hexyl]benzene
MOLECULAR FORMULA: C28H42O4
MOLECULAR WEIGHT: 442.63068
SMILES: CC(C)(C)OOC(C)(CCC(C)(CC1=CC=CC=C1)OOC(C)(C)C)CC2=CC=CC=C2
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Product OPENEYE NAME: [(E)-1,4-bis(tert-butylperoxy)-4-cyclohexyl-1-methyl-pent-2-enyl]cyclohexane
CAS Name: [(E)-2,5-bis(tert-butyldioxy)-5-cyclohexylhex-3-en-2-yl]cyclohexane
IUPAC NAME: [(E)-2,5-bis(tert-butylperoxy)-5-cyclohexylhex-3-en-2-yl]cyclohexane
SYSTEMATIC NAME: [(E)-2,5-bis(tert-butylperoxy)-5-cyclohexyl-hex-3-en-2-yl]cyclohexane
MOLECULAR FORMULA: C26H48O4
MOLECULAR WEIGHT: 424.65692
SMILES: CC(C)(C)OOC(C)(/C=C/C(C)(C1CCCCC1)OOC(C)(C)C)C2CCCCC2
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Product OPENEYE NAME: (E)-4-(6-hydroxyhexoxy)-4-oxo-but-2-enoate
CAS Name: (E)-4-(6-hydroxyhexoxy)-4-oxo-2-butenoate
IUPAC NAME: (E)-4-(6-hydroxyhexoxy)-4-oxobut-2-enoate
SYSTEMATIC NAME: (E)-4-(6-oxidanylhexoxy)-4-oxidanylidene-but-2-enoate
MOLECULAR FORMULA: C10H15O5-
MOLECULAR WEIGHT: 215.2231
SMILES: C(CCCOC(=O)/C=C/C(=O)[O-])CCO
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Product OPENEYE NAME: [butoxy(hydroxy)phosphanyl] dibutyl phosphite
CAS Name: phosphorous acid [butoxy(hydroxy)phosphino] dibutyl ester
IUPAC NAME: [butoxy(hydroxy)phosphanyl] dibutyl phosphite
SYSTEMATIC NAME: [butoxy(oxidanyl)phosphanyl] dibutyl phosphite
MOLECULAR FORMULA: C12H28O5P2
MOLECULAR WEIGHT: 314.295242
SMILES: CCCCOP(O)OP(OCCCC)OCCCC
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Product OPENEYE NAME: butyl acetate; ethyl acetate; toluene; acetate
CAS Name: acetic acid butyl ester; acetic acid ethyl ester; toluene; acetate
IUPAC NAME: butyl acetate; ethyl acetate; toluene; acetate
SYSTEMATIC NAME: butyl ethanoate; ethyl ethanoate; methylbenzene; ethanoate
MOLECULAR FORMULA: C19H31O6-
MOLECULAR WEIGHT: 355.44584
SMILES: CCCCOC(=O)C.CCOC(=O)C.CC1=CC=CC=C1.CC(=O)[O-]
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Product OPENEYE NAME: [ethoxy(hydroxy)phosphanyl] diethyl phosphite
CAS Name: phosphorous acid [ethoxy(hydroxy)phosphino] diethyl ester
IUPAC NAME: [ethoxy(hydroxy)phosphanyl] diethyl phosphite
SYSTEMATIC NAME: [ethoxy(oxidanyl)phosphanyl] diethyl phosphite
MOLECULAR FORMULA: C6H16O5P2
MOLECULAR WEIGHT: 230.135762
SMILES: CCOP(O)OP(OCC)OCC
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Product OPENEYE NAME: N-(4-aminophenyl)-4-formyl-benzamide
CAS Name: N-(4-aminophenyl)-4-formylbenzamide
IUPAC NAME: N-(4-aminophenyl)-4-formylbenzamide
SYSTEMATIC NAME: N-(4-aminophenyl)-4-methanoyl-benzamide
MOLECULAR FORMULA: C14H12N2O2
MOLECULAR WEIGHT: 240.25728
SMILES: C1=CC(=CC=C1C=O)C(=O)NC2=CC=C(C=C2)N
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