Friday, September 28, 2012

All Chemical Compounds Information




Product OPENEYE NAME: 2-(2,6-dimethyl-4-propyl-phenoxy)ethanol
CAS Name: 2-(2,6-dimethyl-4-propylphenoxy)ethanol
IUPAC NAME: 2-(2,6-dimethyl-4-propylphenoxy)ethanol
SYSTEMATIC NAME: 2-(2,6-dimethyl-4-propyl-phenoxy)ethanol
MOLECULAR FORMULA: C13H20O2
MOLECULAR WEIGHT: 208.2967
SMILES: CCCC1=CC(=C(C(=C1)C)OCCO)C
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Product OPENEYE NAME: 5-(2-ethoxyphenyl)heptan-1-ol
CAS Name: 5-(2-ethoxyphenyl)-1-heptanol
IUPAC NAME: 5-(2-ethoxyphenyl)heptan-1-ol
SYSTEMATIC NAME: 5-(2-ethoxyphenyl)heptan-1-ol
MOLECULAR FORMULA: C15H24O2
MOLECULAR WEIGHT: 236.34986
SMILES: CCC(CCCCO)C1=CC=CC=C1OCC
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Product OPENEYE NAME: 2-heptylhexane-1,3-diol
CAS Name: 2-heptylhexane-1,3-diol
IUPAC NAME: 2-heptylhexane-1,3-diol
SYSTEMATIC NAME: 2-heptylhexane-1,3-diol
MOLECULAR FORMULA: C13H28O2
MOLECULAR WEIGHT: 216.36022
SMILES: CCCCCCCC(CO)C(CCC)O
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Product OPENEYE NAME: 2-(2,6-diethyl-4-propyl-phenoxy)ethanol
CAS Name: 2-(2,6-diethyl-4-propylphenoxy)ethanol
IUPAC NAME: 2-(2,6-diethyl-4-propylphenoxy)ethanol
SYSTEMATIC NAME: 2-(2,6-diethyl-4-propyl-phenoxy)ethanol
MOLECULAR FORMULA: C15H24O2
MOLECULAR WEIGHT: 236.34986
SMILES: CCCC1=CC(=C(C(=C1)CC)OCCO)CC
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Product OPENEYE NAME: 2-(2,3-dipentyl-4-propyl-phenoxy)ethanol
CAS Name: 2-(2,3-dipentyl-4-propylphenoxy)ethanol
IUPAC NAME: 2-(2,3-dipentyl-4-propylphenoxy)ethanol
SYSTEMATIC NAME: 2-(2,3-dipentyl-4-propyl-phenoxy)ethanol
MOLECULAR FORMULA: C21H36O2
MOLECULAR WEIGHT: 320.50934
SMILES: CCCCCC1=C(C=CC(=C1CCCCC)OCCO)CCC
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Product OPENEYE NAME: 3-ethyl-4-methyl-pentane-1,3-diol
CAS Name: 3-ethyl-4-methylpentane-1,3-diol
IUPAC NAME: 3-ethyl-4-methylpentane-1,3-diol
SYSTEMATIC NAME: 3-ethyl-4-methyl-pentane-1,3-diol
MOLECULAR FORMULA: C8H18O2
MOLECULAR WEIGHT: 146.22732
SMILES: CCC(CCO)(C(C)C)O
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Product OPENEYE NAME: 2-(2,3-dichloro-4-propyl-phenoxy)ethanol
CAS Name: 2-(2,3-dichloro-4-propylphenoxy)ethanol
IUPAC NAME: 2-(2,3-dichloro-4-propylphenoxy)ethanol
SYSTEMATIC NAME: 2-[2,3-bis(chloranyl)-4-propyl-phenoxy]ethanol
MOLECULAR FORMULA: C11H14Cl2O2
MOLECULAR WEIGHT: 249.13366
SMILES: CCCC1=C(C(=C(C=C1)OCCO)Cl)Cl
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Product OPENEYE NAME: 1,1,2-trimethyl-3-phenyl-indene-4,5-dicarboxylic acid
CAS Name: 1,1,2-trimethyl-3-phenylindene-4,5-dicarboxylic acid
IUPAC NAME: 1,1,2-trimethyl-3-phenylindene-4,5-dicarboxylic acid
SYSTEMATIC NAME: 1,1,2-trimethyl-3-phenyl-indene-4,5-dicarboxylic acid
MOLECULAR FORMULA: C20H18O4
MOLECULAR WEIGHT: 322.35452
SMILES: CC1=C(C2=C(C1(C)C)C=CC(=C2C(=O)O)C(=O)O)C3=CC=CC=C3
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Product OPENEYE NAME: 2-[4-[4-(2-hydroxyethoxy)-2,3-dimethyl-phenoxy]-2,3-dimethyl-phenoxy]ethanol
CAS Name: 2-[4-[4-(2-hydroxyethoxy)-2,3-dimethylphenoxy]-2,3-dimethylphenoxy]ethanol
IUPAC NAME: 2-[4-[4-(2-hydroxyethoxy)-2,3-dimethylphenoxy]-2,3-dimethylphenoxy]ethanol
SYSTEMATIC NAME: 2-[4-[4-(2-hydroxyethyloxy)-2,3-dimethyl-phenoxy]-2,3-dimethyl-phenoxy]ethanol
MOLECULAR FORMULA: C20H26O5
MOLECULAR WEIGHT: 346.41744
SMILES: CC1=C(C=CC(=C1C)OC2=C(C(=C(C=C2)OCCO)C)C)OCCO
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Product OPENEYE NAME: 2-[4-[4-(2-hydroxyethoxy)-2,3-dimethyl-phenyl]sulfanyl-2,3-dimethyl-phenoxy]ethanol
CAS Name: 2-[4-[[4-(2-hydroxyethoxy)-2,3-dimethylphenyl]thio]-2,3-dimethylphenoxy]ethanol
IUPAC NAME: 2-[4-[4-(2-hydroxyethoxy)-2,3-dimethylphenyl]sulfanyl-2,3-dimethylphenoxy]ethanol
SYSTEMATIC NAME: 2-[4-[4-(2-hydroxyethyloxy)-2,3-dimethyl-phenyl]sulfanyl-2,3-dimethyl-phenoxy]ethanol
MOLECULAR FORMULA: C20H26O4S
MOLECULAR WEIGHT: 362.48304
SMILES: CC1=C(C=CC(=C1C)SC2=C(C(=C(C=C2)OCCO)C)C)OCCO
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Product OPENEYE NAME: 2-(2-isopropyl-4-propyl-phenoxy)ethanol
CAS Name: 2-(2-propan-2-yl-4-propylphenoxy)ethanol
IUPAC NAME: 2-(2-propan-2-yl-4-propylphenoxy)ethanol
SYSTEMATIC NAME: 2-(2-propan-2-yl-4-propyl-phenoxy)ethanol
MOLECULAR FORMULA: C14H22O2
MOLECULAR WEIGHT: 222.32328
SMILES: CCCC1=CC(=C(C=C1)OCCO)C(C)C
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Product OPENEYE NAME: 2-(2,3-dibromo-4-propyl-phenoxy)ethanol
CAS Name: 2-(2,3-dibromo-4-propylphenoxy)ethanol
IUPAC NAME: 2-(2,3-dibromo-4-propylphenoxy)ethanol
SYSTEMATIC NAME: 2-[2,3-bis(bromanyl)-4-propyl-phenoxy]ethanol
MOLECULAR FORMULA: C11H14Br2O2
MOLECULAR WEIGHT: 338.03566
SMILES: CCCC1=C(C(=C(C=C1)OCCO)Br)Br
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Product OPENEYE NAME: 1-[2-[2-(1-hydroxyethoxy)phenoxy]phenoxy]ethanol
CAS Name: 1-[2-[2-(1-hydroxyethoxy)phenoxy]phenoxy]ethanol
IUPAC NAME: 1-[2-[2-(1-hydroxyethoxy)phenoxy]phenoxy]ethanol
SYSTEMATIC NAME: 1-[2-[2-(1-hydroxyethyloxy)phenoxy]phenoxy]ethanol
MOLECULAR FORMULA: C16H18O5
MOLECULAR WEIGHT: 290.31112
SMILES: CC(O)OC1=CC=CC=C1OC2=CC=CC=C2OC(C)O
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Product OPENEYE NAME: 2-(2-methyl-4-propyl-phenoxy)ethanol
CAS Name: 2-(2-methyl-4-propylphenoxy)ethanol
IUPAC NAME: 2-(2-methyl-4-propylphenoxy)ethanol
SYSTEMATIC NAME: 2-(2-methyl-4-propyl-phenoxy)ethanol
MOLECULAR FORMULA: C12H18O2
MOLECULAR WEIGHT: 194.27012
SMILES: CCCC1=CC(=C(C=C1)OCCO)C
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Product OPENEYE NAME: 2-[4-(1,2,2,3,3,3-hexafluoropropyl)-2,6-dimethyl-phenoxy]ethanol
CAS Name: 2-[4-(1,2,2,3,3,3-hexafluoropropyl)-2,6-dimethylphenoxy]ethanol
IUPAC NAME: 2-[4-(1,2,2,3,3,3-hexafluoropropyl)-2,6-dimethylphenoxy]ethanol
SYSTEMATIC NAME: 2-[4-[1,2,2,3,3,3-hexakis(fluoranyl)propyl]-2,6-dimethyl-phenoxy]ethanol
MOLECULAR FORMULA: C13H14F6O2
MOLECULAR WEIGHT: 316.239479
SMILES: CC1=CC(=CC(=C1OCCO)C)C(C(C(F)(F)F)(F)F)F
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Product OPENEYE NAME: 2-[4-methyl-3-(trifluoromethyl)isoxazol-5-yl]oxyacetate
CAS Name: 2-[[4-methyl-3-(trifluoromethyl)-5-isoxazolyl]oxy]acetate
IUPAC NAME: 2-[[4-methyl-3-(trifluoromethyl)-1,2-oxazol-5-yl]oxy]acetate
SYSTEMATIC NAME: 2-[[4-methyl-3-(trifluoromethyl)-1,2-oxazol-5-yl]oxy]ethanoate
MOLECULAR FORMULA: C7H5F3NO4-
MOLECULAR WEIGHT: 224.11411
SMILES: CC1=C(ON=C1C(F)(F)F)OCC(=O)[O-]
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