Wednesday, September 28, 2011

All Chemical Compounds Information




Product OPENEYE NAME: O-(p-tolyl) 3,3,3-trifluoro-2-(trifluoromethyl)propanethioate
CAS Name: 3,3,3-trifluoro-2-(trifluoromethyl)propanethioic acid O-(4-methylphenyl) ester
IUPAC NAME: O-(4-methylphenyl) 3,3,3-trifluoro-2-(trifluoromethyl)propanethioate
SYSTEMATIC NAME: O-(4-methylphenyl) 3,3,3-tris(fluoranyl)-2-(trifluoromethyl)propanethioate
MOLECULAR FORMULA: C11H8F6OS
MOLECULAR WEIGHT: 302.236039
SMILES: CC1=CC=C(C=C1)OC(=S)C(C(F)(F)F)C(F)(F)F
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Product OPENEYE NAME: 1-(2,2,3,4,4,4-hexafluorobutyl)-4-methyl-benzene
CAS Name: 1-(2,2,3,4,4,4-hexafluorobutyl)-4-methylbenzene
IUPAC NAME: 1-(2,2,3,4,4,4-hexafluorobutyl)-4-methylbenzene
SYSTEMATIC NAME: 1-[2,2,3,4,4,4-hexakis(fluoranyl)butyl]-4-methyl-benzene
MOLECULAR FORMULA: C11H10F6
MOLECULAR WEIGHT: 256.187519
SMILES: CC1=CC=C(C=C1)CC(C(C(F)(F)F)F)(F)F
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Product OPENEYE NAME: 1-(p-tolyl)-2,2-bis(trifluoromethyl)aziridine
CAS Name: 1-(4-methylphenyl)-2,2-bis(trifluoromethyl)aziridine
IUPAC NAME: 1-(4-methylphenyl)-2,2-bis(trifluoromethyl)aziridine
SYSTEMATIC NAME: 1-(4-methylphenyl)-2,2-bis(trifluoromethyl)aziridine
MOLECULAR FORMULA: C11H9F6N
MOLECULAR WEIGHT: 269.186279
SMILES: CC1=CC=C(C=C1)N2CC2(C(F)(F)F)C(F)(F)F
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Product OPENEYE NAME: 1-(4-methoxyphenyl)-2,2-bis(trifluoromethyl)aziridine
CAS Name: 1-(4-methoxyphenyl)-2,2-bis(trifluoromethyl)aziridine
IUPAC NAME: 1-(4-methoxyphenyl)-2,2-bis(trifluoromethyl)aziridine
SYSTEMATIC NAME: 1-(4-methoxyphenyl)-2,2-bis(trifluoromethyl)aziridine
MOLECULAR FORMULA: C11H9F6NO
MOLECULAR WEIGHT: 285.185679
SMILES: COC1=CC=C(C=C1)N2CC2(C(F)(F)F)C(F)(F)F
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Product OPENEYE NAME: 1-tert-butyl-3,4-bis(trifluoromethyl)pyrrole-2-carbonitrile
CAS Name: 1-tert-butyl-3,4-bis(trifluoromethyl)-2-pyrrolecarbonitrile
IUPAC NAME: 1-tert-butyl-3,4-bis(trifluoromethyl)pyrrole-2-carbonitrile
SYSTEMATIC NAME: 1-tert-butyl-3,4-bis(trifluoromethyl)pyrrole-2-carbonitrile
MOLECULAR FORMULA: C11H10F6N2
MOLECULAR WEIGHT: 284.200919
SMILES: CC(C)(C)N1C=C(C(=C1C#N)C(F)(F)F)C(F)(F)F
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Product OPENEYE NAME: 1-tert-butyl-3,4-bis(trifluoromethyl)pyrrole-2-carboxylic acid
CAS Name: 1-tert-butyl-3,4-bis(trifluoromethyl)-2-pyrrolecarboxylic acid
IUPAC NAME: 1-tert-butyl-3,4-bis(trifluoromethyl)pyrrole-2-carboxylic acid
SYSTEMATIC NAME: 1-tert-butyl-3,4-bis(trifluoromethyl)pyrrole-2-carboxylic acid
MOLECULAR FORMULA: C11H11F6NO2
MOLECULAR WEIGHT: 303.200959
SMILES: CC(C)(C)N1C=C(C(=C1C(=O)O)C(F)(F)F)C(F)(F)F
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Product OPENEYE NAME: N-[2,2,2-trifluoro-1-phenoxy-1-(trifluoromethyl)ethyl]ethanesulfinamide
CAS Name: N-(1,1,1,3,3,3-hexafluoro-2-phenoxypropan-2-yl)ethanesulfinamide
IUPAC NAME: N-(1,1,1,3,3,3-hexafluoro-2-phenoxypropan-2-yl)ethanesulfinamide
SYSTEMATIC NAME: N-[1,1,1,3,3,3-hexakis(fluoranyl)-2-phenoxy-propan-2-yl]ethanesulfinamide
MOLECULAR FORMULA: C11H11F6NO2S
MOLECULAR WEIGHT: 335.265959
SMILES: CCS(=O)NC(C(F)(F)F)(C(F)(F)F)OC1=CC=CC=C1
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Product OPENEYE NAME: 1,3,5-trifluoro-7-(trifluoromethyl)adamantane
CAS Name: 1,3,5-trifluoro-7-(trifluoromethyl)adamantane
IUPAC NAME: 1,3,5-trifluoro-7-(trifluoromethyl)adamantane
SYSTEMATIC NAME: 1,3,5-tris(fluoranyl)-7-(trifluoromethyl)adamantane
MOLECULAR FORMULA: C11H12F6
MOLECULAR WEIGHT: 258.203399
SMILES: C1C2(CC3(CC1(CC(C2)(C3)F)F)F)C(F)(F)F
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Product OPENEYE NAME: (4S,5R)-4-methyl-5-pentyl-2,2-bis(trifluoromethyl)-1,3-dioxolane
CAS Name: (4S,5R)-4-methyl-5-pentyl-2,2-bis(trifluoromethyl)-1,3-dioxolane
IUPAC NAME: (4S,5R)-4-methyl-5-pentyl-2,2-bis(trifluoromethyl)-1,3-dioxolane
SYSTEMATIC NAME: (4S,5R)-4-methyl-5-pentyl-2,2-bis(trifluoromethyl)-1,3-dioxolane
MOLECULAR FORMULA: C11H16F6O2
MOLECULAR WEIGHT: 294.233959
SMILES: CCCCC[C@@H]1[C@@H](OC(O1)(C(F)(F)F)C(F)(F)F)C
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Product OPENEYE NAME: (4R,5S)-4-butyl-5-ethyl-2,2-bis(trifluoromethyl)-1,3-dioxolane
CAS Name: (4R,5S)-4-butyl-5-ethyl-2,2-bis(trifluoromethyl)-1,3-dioxolane
IUPAC NAME: (4R,5S)-4-butyl-5-ethyl-2,2-bis(trifluoromethyl)-1,3-dioxolane
SYSTEMATIC NAME: (4R,5S)-4-butyl-5-ethyl-2,2-bis(trifluoromethyl)-1,3-dioxolane
MOLECULAR FORMULA: C11H16F6O2
MOLECULAR WEIGHT: 294.233959
SMILES: CCCC[C@@H]1[C@@H](OC(O1)(C(F)(F)F)C(F)(F)F)CC
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Product OPENEYE NAME: (4S,5R)-4,5-dipropyl-2,2-bis(trifluoromethyl)-1,3-dioxolane
CAS Name: (4S,5R)-4,5-dipropyl-2,2-bis(trifluoromethyl)-1,3-dioxolane
IUPAC NAME: (4S,5R)-4,5-dipropyl-2,2-bis(trifluoromethyl)-1,3-dioxolane
SYSTEMATIC NAME: (4S,5R)-4,5-dipropyl-2,2-bis(trifluoromethyl)-1,3-dioxolane
MOLECULAR FORMULA: C11H16F6O2
MOLECULAR WEIGHT: 294.233959
SMILES: CCC[C@@H]1[C@@H](OC(O1)(C(F)(F)F)C(F)(F)F)CCC
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Product OPENEYE NAME: (4S,5S)-4-methyl-5-pentyl-2,2-bis(trifluoromethyl)-1,3-dioxolane
CAS Name: (4S,5S)-4-methyl-5-pentyl-2,2-bis(trifluoromethyl)-1,3-dioxolane
IUPAC NAME: (4S,5S)-4-methyl-5-pentyl-2,2-bis(trifluoromethyl)-1,3-dioxolane
SYSTEMATIC NAME: (4S,5S)-4-methyl-5-pentyl-2,2-bis(trifluoromethyl)-1,3-dioxolane
MOLECULAR FORMULA: C11H16F6O2
MOLECULAR WEIGHT: 294.233959
SMILES: CCCCC[C@H]1[C@@H](OC(O1)(C(F)(F)F)C(F)(F)F)C
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Product OPENEYE NAME: (4S,5S)-4-butyl-5-ethyl-2,2-bis(trifluoromethyl)-1,3-dioxolane
CAS Name: (4S,5S)-4-butyl-5-ethyl-2,2-bis(trifluoromethyl)-1,3-dioxolane
IUPAC NAME: (4S,5S)-4-butyl-5-ethyl-2,2-bis(trifluoromethyl)-1,3-dioxolane
SYSTEMATIC NAME: (4S,5S)-4-butyl-5-ethyl-2,2-bis(trifluoromethyl)-1,3-dioxolane
MOLECULAR FORMULA: C11H16F6O2
MOLECULAR WEIGHT: 294.233959
SMILES: CCCC[C@H]1[C@@H](OC(O1)(C(F)(F)F)C(F)(F)F)CC
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Product OPENEYE NAME: (4S,5S)-4,5-dipropyl-2,2-bis(trifluoromethyl)-1,3-dioxolane
CAS Name: (4S,5S)-4,5-dipropyl-2,2-bis(trifluoromethyl)-1,3-dioxolane
IUPAC NAME: (4S,5S)-4,5-dipropyl-2,2-bis(trifluoromethyl)-1,3-dioxolane
SYSTEMATIC NAME: (4S,5S)-4,5-dipropyl-2,2-bis(trifluoromethyl)-1,3-dioxolane
MOLECULAR FORMULA: C11H16F6O2
MOLECULAR WEIGHT: 294.233959
SMILES: CCC[C@H]1[C@@H](OC(O1)(C(F)(F)F)C(F)(F)F)CCC
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Product OPENEYE NAME: [1,2,2,2-tetrafluoro-1-(trifluoromethyl)ethyl] benzoate
CAS Name: benzoic acid 1,1,1,2,3,3,3-heptafluoropropan-2-yl ester
IUPAC NAME: 1,1,1,2,3,3,3-heptafluoropropan-2-yl benzoate
SYSTEMATIC NAME: 1,1,1,2,3,3,3-heptakis(fluoranyl)propan-2-yl benzoate
MOLECULAR FORMULA: C10H5F7O2
MOLECULAR WEIGHT: 290.134322
SMILES: C1=CC=C(C=C1)C(=O)OC(C(F)(F)F)(C(F)(F)F)F
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