Saturday, July 30, 2011

All Chemical Compounds Information




Product OPENEYE NAME: 2-(butylamino)ethanol
CAS Name: 2-(butylamino)ethanol
IUPAC NAME: 2-(butylamino)ethanol
SYSTEMATIC NAME: 2-(butylamino)ethanol
MOLECULAR FORMULA: C6H15NO
MOLECULAR WEIGHT: 117.1894
SMILES: CCCCNCCO
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Product OPENEYE NAME: 2-butoxyethanol
CAS Name: 2-butoxyethanol
IUPAC NAME: 2-butoxyethanol
SYSTEMATIC NAME: 2-butoxyethanol
MOLECULAR FORMULA: C6H14O2
MOLECULAR WEIGHT: 118.17416
SMILES: CCCCOCCO
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Product OPENEYE NAME: 2-(2-methoxyethoxy)ethanol
CAS Name: 2-(2-methoxyethoxy)ethanol
IUPAC NAME: 2-(2-methoxyethoxy)ethanol
SYSTEMATIC NAME: 2-(2-methoxyethoxy)ethanol
MOLECULAR FORMULA: C5H12O3
MOLECULAR WEIGHT: 120.14698
SMILES: COCCOCCO
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Product OPENEYE NAME: cycloocta-1,5-diene
CAS Name: cycloocta-1,5-diene
IUPAC NAME: cycloocta-1,5-diene
SYSTEMATIC NAME: cycloocta-1,5-diene
MOLECULAR FORMULA: C8H12
MOLECULAR WEIGHT: 108.18088
SMILES: C1CC=CCCC=C1
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Product OPENEYE NAME: methyl non-2-enoate
CAS Name: 2-nonenoic acid methyl ester
IUPAC NAME: methyl non-2-enoate
SYSTEMATIC NAME: methyl non-2-enoate
MOLECULAR FORMULA: C10H18O2
MOLECULAR WEIGHT: 170.24872
SMILES: CCCCCCC=CC(=O)OC
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Product OPENEYE NAME: methyl non-2-ynoate
CAS Name: 2-nonynoic acid methyl ester
IUPAC NAME: methyl non-2-ynoate
SYSTEMATIC NAME: methyl non-2-ynoate
MOLECULAR FORMULA: C10H16O2
MOLECULAR WEIGHT: 168.23284
SMILES: CCCCCCC#CC(=O)OC
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Product OPENEYE NAME: methyl undec-10-enoate
CAS Name: 10-undecenoic acid methyl ester
IUPAC NAME: methyl undec-10-enoate
SYSTEMATIC NAME: methyl undec-10-enoate
MOLECULAR FORMULA: C12H22O2
MOLECULAR WEIGHT: 198.30188
SMILES: COC(=O)CCCCCCCCC=C
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Product OPENEYE NAME: methyl dodecanoate
CAS Name: dodecanoic acid methyl ester
IUPAC NAME: methyl dodecanoate
SYSTEMATIC NAME: methyl dodecanoate
MOLECULAR FORMULA: C13H26O2
MOLECULAR WEIGHT: 214.34434
SMILES: CCCCCCCCCCCC(=O)OC
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Product OPENEYE NAME: 1-bromooctane
CAS Name: 1-bromooctane
IUPAC NAME: 1-bromooctane
SYSTEMATIC NAME: 1-bromanyloctane
MOLECULAR FORMULA: C8H17Br
MOLECULAR WEIGHT: 193.12458
SMILES: CCCCCCCCBr
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Product OPENEYE NAME: nonane
CAS Name: nonane
IUPAC NAME: nonane
SYSTEMATIC NAME: nonane
MOLECULAR FORMULA: C9H20
MOLECULAR WEIGHT: 128.2551
SMILES: CCCCCCCCC
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Product OPENEYE NAME: 1-chlorooctane
CAS Name: 1-chlorooctane
IUPAC NAME: 1-chlorooctane
SYSTEMATIC NAME: 1-chloranyloctane
MOLECULAR FORMULA: C8H17Cl
MOLECULAR WEIGHT: 148.67358
SMILES: CCCCCCCCCl
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Product OPENEYE NAME: octan-1-amine
CAS Name: 1-octanamine
IUPAC NAME: octan-1-amine
SYSTEMATIC NAME: octan-1-amine
MOLECULAR FORMULA: C8H19N
MOLECULAR WEIGHT: 129.24316
SMILES: CCCCCCCCN
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Product OPENEYE NAME: octane-1-thiol
CAS Name: 1-octanethiol
IUPAC NAME: octane-1-thiol
SYSTEMATIC NAME: octane-1-thiol
MOLECULAR FORMULA: C8H18S
MOLECULAR WEIGHT: 146.29352
SMILES: CCCCCCCCS
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Product OPENEYE NAME: 1,5-dimethoxypentane
CAS Name: 1,5-dimethoxypentane
IUPAC NAME: 1,5-dimethoxypentane
SYSTEMATIC NAME: 1,5-dimethoxypentane
MOLECULAR FORMULA: C7H16O2
MOLECULAR WEIGHT: 132.20074
SMILES: COCCCCCOC
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Product OPENEYE NAME: 2-(2-ethoxyethoxy)ethanol
CAS Name: 2-(2-ethoxyethoxy)ethanol
IUPAC NAME: 2-(2-ethoxyethoxy)ethanol
SYSTEMATIC NAME: 2-(2-ethoxyethoxy)ethanol
MOLECULAR FORMULA: C6H14O3
MOLECULAR WEIGHT: 134.17356
SMILES: CCOCCOCCO
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Product OPENEYE NAME: 1-chloro-2-(2-chloroethoxymethoxy)ethane
CAS Name: 1-chloro-2-(2-chloroethoxymethoxy)ethane
IUPAC NAME: 1-chloro-2-(2-chloroethoxymethoxy)ethane
SYSTEMATIC NAME: 1-chloranyl-2-(2-chloroethyloxymethoxy)ethane
MOLECULAR FORMULA: C5H10Cl2O2
MOLECULAR WEIGHT: 173.0377
SMILES: C(CCl)OCOCCCl
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Product OPENEYE NAME: N-butylbutan-1-amine
CAS Name: N-butyl-1-butanamine
IUPAC NAME: N-butylbutan-1-amine
SYSTEMATIC NAME: N-butylbutan-1-amine
MOLECULAR FORMULA: C8H19N
MOLECULAR WEIGHT: 129.24316
SMILES: CCCCNCCCC
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Product OPENEYE NAME: 3-(2-cyanoethylamino)propanenitrile
CAS Name: 3-(2-cyanoethylamino)propanenitrile
IUPAC NAME: 3-(2-cyanoethylamino)propanenitrile
SYSTEMATIC NAME: 3-(2-cyanoethylamino)propanenitrile
MOLECULAR FORMULA: C6H9N3
MOLECULAR WEIGHT: 123.15576
SMILES: C(CNCCC#N)C#N
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