Saturday, July 30, 2011

All Chemical Compounds Information




Product OPENEYE NAME: 2-[2-(2-hydroxyethoxy)ethoxy]ethanol
CAS Name: 2-[2-(2-hydroxyethoxy)ethoxy]ethanol
IUPAC NAME: 2-[2-(2-hydroxyethoxy)ethoxy]ethanol
SYSTEMATIC NAME: 2-[2-(2-hydroxyethyloxy)ethoxy]ethanol
MOLECULAR FORMULA: C6H14O4
MOLECULAR WEIGHT: 150.17296
SMILES: C(COCCOCCO)O
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Product OPENEYE NAME: 1-bromodecane
CAS Name: 1-bromodecane
IUPAC NAME: 1-bromodecane
SYSTEMATIC NAME: 1-bromanyldecane
MOLECULAR FORMULA: C10H21Br
MOLECULAR WEIGHT: 221.17774
SMILES: CCCCCCCCCCBr
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Product OPENEYE NAME: decan-1-ol
CAS Name: 1-decanol
IUPAC NAME: decan-1-ol
SYSTEMATIC NAME: decan-1-ol
MOLECULAR FORMULA: C10H22O
MOLECULAR WEIGHT: 158.28108
SMILES: CCCCCCCCCCO
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Product OPENEYE NAME: decanal
CAS Name: decanal
IUPAC NAME: decanal
SYSTEMATIC NAME: decanal
MOLECULAR FORMULA: C10H20O
MOLECULAR WEIGHT: 156.2652
SMILES: CCCCCCCCCC=O
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Product OPENEYE NAME: octyl formate
CAS Name: formic acid octyl ester
IUPAC NAME: octyl formate
SYSTEMATIC NAME: octyl methanoate
MOLECULAR FORMULA: C9H18O2
MOLECULAR WEIGHT: 158.23802
SMILES: CCCCCCCCOC=O
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Product OPENEYE NAME: 2-(2-butoxyethoxy)ethanol
CAS Name: 2-(2-butoxyethoxy)ethanol
IUPAC NAME: 2-(2-butoxyethoxy)ethanol
SYSTEMATIC NAME: 2-(2-butoxyethoxy)ethanol
MOLECULAR FORMULA: C8H18O3
MOLECULAR WEIGHT: 162.22672
SMILES: CCCCOCCOCCO
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Product OPENEYE NAME: 2-[2-(2-methoxyethoxy)ethoxy]ethanol
CAS Name: 2-[2-(2-methoxyethoxy)ethoxy]ethanol
IUPAC NAME: 2-[2-(2-methoxyethoxy)ethoxy]ethanol
SYSTEMATIC NAME: 2-[2-(2-methoxyethoxy)ethoxy]ethanol
MOLECULAR FORMULA: C7H16O4
MOLECULAR WEIGHT: 164.19954
SMILES: COCCOCCOCCO
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Product OPENEYE NAME: 1-ethoxy-2-(2-ethoxyethoxy)ethane
CAS Name: 1-ethoxy-2-(2-ethoxyethoxy)ethane
IUPAC NAME: 1-ethoxy-2-(2-ethoxyethoxy)ethane
SYSTEMATIC NAME: 1-ethoxy-2-(2-ethoxyethoxy)ethane
MOLECULAR FORMULA: C8H18O3
MOLECULAR WEIGHT: 162.22672
SMILES: CCOCCOCCOCC
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Product OPENEYE NAME: undecanoic acid
CAS Name: undecanoic acid
IUPAC NAME: undecanoic acid
SYSTEMATIC NAME: undecanoic acid
MOLECULAR FORMULA: C11H22O2
MOLECULAR WEIGHT: 186.29118
SMILES: CCCCCCCCCCC(=O)O
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Product OPENEYE NAME: methyl hexadecanoate
CAS Name: hexadecanoic acid methyl ester
IUPAC NAME: methyl hexadecanoate
SYSTEMATIC NAME: methyl hexadecanoate
MOLECULAR FORMULA: C17H34O2
MOLECULAR WEIGHT: 270.45066
SMILES: CCCCCCCCCCCCCCCC(=O)OC
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Product OPENEYE NAME: dodecane
CAS Name: dodecane
IUPAC NAME: dodecane
SYSTEMATIC NAME: dodecane
MOLECULAR FORMULA: C12H26
MOLECULAR WEIGHT: 170.33484
SMILES: CCCCCCCCCCCC
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Product OPENEYE NAME: dodec-1-ene
CAS Name: 1-dodecene
IUPAC NAME: dodec-1-ene
SYSTEMATIC NAME: dodec-1-ene
MOLECULAR FORMULA: C12H24
MOLECULAR WEIGHT: 168.31896
SMILES: CCCCCCCCCCC=C
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Product OPENEYE NAME: undecan-1-ol
CAS Name: 1-undecanol
IUPAC NAME: undecan-1-ol
SYSTEMATIC NAME: undecan-1-ol
MOLECULAR FORMULA: C11H24O
MOLECULAR WEIGHT: 172.30766
SMILES: CCCCCCCCCCCO
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Product OPENEYE NAME: undec-10-en-1-ol
CAS Name: 10-undecen-1-ol
IUPAC NAME: undec-10-en-1-ol
SYSTEMATIC NAME: undec-10-en-1-ol
MOLECULAR FORMULA: C11H22O
MOLECULAR WEIGHT: 170.29178
SMILES: C=CCCCCCCCCCO
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Product OPENEYE NAME: undecanal
CAS Name: undecanal
IUPAC NAME: undecanal
SYSTEMATIC NAME: undecanal
MOLECULAR FORMULA: C11H22O
MOLECULAR WEIGHT: 170.29178
SMILES: CCCCCCCCCCC=O
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Product OPENEYE NAME: undec-10-enal
CAS Name: 10-undecenal
IUPAC NAME: undec-10-enal
SYSTEMATIC NAME: undec-10-enal
MOLECULAR FORMULA: C11H20O
MOLECULAR WEIGHT: 168.2759
SMILES: C=CCCCCCCCCC=O
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Product OPENEYE NAME: 1-(2-butoxyethoxy)butane
CAS Name: 1-(2-butoxyethoxy)butane
IUPAC NAME: 1-(2-butoxyethoxy)butane
SYSTEMATIC NAME: 1-(2-butoxyethoxy)butane
MOLECULAR FORMULA: C10H22O2
MOLECULAR WEIGHT: 174.28048
SMILES: CCCCOCCOCCCC
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Product OPENEYE NAME: 1-methoxy-2-[2-(2-methoxyethoxy)ethoxy]ethane
CAS Name: 1-methoxy-2-[2-(2-methoxyethoxy)ethoxy]ethane
IUPAC NAME: 1-methoxy-2-[2-(2-methoxyethoxy)ethoxy]ethane
SYSTEMATIC NAME: 1-methoxy-2-[2-(2-methoxyethoxy)ethoxy]ethane
MOLECULAR FORMULA: C8H18O4
MOLECULAR WEIGHT: 178.22612
SMILES: COCCOCCOCCOC
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Product OPENEYE NAME: 2-[2-(2-ethoxyethoxy)ethoxy]ethanol
CAS Name: 2-[2-(2-ethoxyethoxy)ethoxy]ethanol
IUPAC NAME: 2-[2-(2-ethoxyethoxy)ethoxy]ethanol
SYSTEMATIC NAME: 2-[2-(2-ethoxyethoxy)ethoxy]ethanol
MOLECULAR FORMULA: C8H18O4
MOLECULAR WEIGHT: 178.22612
SMILES: CCOCCOCCOCCO
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Product OPENEYE NAME: 1-(pentyldisulfanyl)pentane
CAS Name: 1-(pentyldisulfanyl)pentane
IUPAC NAME: 1-(pentyldisulfanyl)pentane
SYSTEMATIC NAME: 1-(pentyldisulfanyl)pentane
MOLECULAR FORMULA: C10H22S2
MOLECULAR WEIGHT: 206.41168
SMILES: CCCCCSSCCCCC
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Product OPENEYE NAME: 1-chlorododecane
CAS Name: 1-chlorododecane
IUPAC NAME: 1-chlorododecane
SYSTEMATIC NAME: 1-chloranyldodecane
MOLECULAR FORMULA: C12H25Cl
MOLECULAR WEIGHT: 204.7799
SMILES: CCCCCCCCCCCCCl
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Product OPENEYE NAME: dodecan-1-ol
CAS Name: 1-dodecanol
IUPAC NAME: dodecan-1-ol
SYSTEMATIC NAME: dodecan-1-ol
MOLECULAR FORMULA: C12H26O
MOLECULAR WEIGHT: 186.33424
SMILES: CCCCCCCCCCCCO
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Product OPENEYE NAME: dodecanal
CAS Name: dodecanal
IUPAC NAME: dodecanal
SYSTEMATIC NAME: dodecanal
MOLECULAR FORMULA: C12H24O
MOLECULAR WEIGHT: 184.31836
SMILES: CCCCCCCCCCCC=O
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Product OPENEYE NAME: dodecane-1-thiol
CAS Name: 1-dodecanethiol
IUPAC NAME: dodecane-1-thiol
SYSTEMATIC NAME: dodecane-1-thiol
MOLECULAR FORMULA: C12H26S
MOLECULAR WEIGHT: 202.39984
SMILES: CCCCCCCCCCCCS
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