Saturday, July 30, 2011

All Chemical Compounds Information




Product OPENEYE NAME: cyclohexene
CAS Name: cyclohexene
IUPAC NAME: cyclohexene
SYSTEMATIC NAME: cyclohexene
MOLECULAR FORMULA: C6H10
MOLECULAR WEIGHT: 82.1436
SMILES: C1CCC=CC1
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Product OPENEYE NAME: 3,4-dihydro-2H-pyran
CAS Name: 3,4-dihydro-2H-pyran
IUPAC NAME: 3,4-dihydro-2H-pyran
SYSTEMATIC NAME: 3,4-dihydro-2H-pyran
MOLECULAR FORMULA: C5H8O
MOLECULAR WEIGHT: 84.11642
SMILES: C1CC=COC1
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Product OPENEYE NAME: 1,3,5-trioxane
CAS Name: 1,3,5-trioxane
IUPAC NAME: 1,3,5-trioxane
SYSTEMATIC NAME: 1,3,5-trioxane
MOLECULAR FORMULA: C3H6O3
MOLECULAR WEIGHT: 90.07794
SMILES: C1OCOCO1
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Product OPENEYE NAME: piperidine
CAS Name: piperidine
IUPAC NAME: piperidine
SYSTEMATIC NAME: piperidine
MOLECULAR FORMULA: C5H11N
MOLECULAR WEIGHT: 85.14754
SMILES: C1CCNCC1
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Product OPENEYE NAME: morpholine
CAS Name: morpholine
IUPAC NAME: morpholine
SYSTEMATIC NAME: morpholine
MOLECULAR FORMULA: C4H9NO
MOLECULAR WEIGHT: 87.12036
SMILES: C1COCCN1
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Product OPENEYE NAME: N,N,N',N'-tetramethylpropane-1,3-diamine
CAS Name: N,N,N',N'-tetramethylpropane-1,3-diamine
IUPAC NAME: N,N,N',N'-tetramethylpropane-1,3-diamine
SYSTEMATIC NAME: N,N,N',N'-tetramethylpropane-1,3-diamine
MOLECULAR FORMULA: C7H18N2
MOLECULAR WEIGHT: 130.23122
SMILES: CN(C)CCCN(C)C
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Product OPENEYE NAME: N-isobutyl-2-methyl-propan-1-amine
CAS Name: 2-methyl-N-(2-methylpropyl)-1-propanamine
IUPAC NAME: 2-methyl-N-(2-methylpropyl)propan-1-amine
SYSTEMATIC NAME: 2-methyl-N-(2-methylpropyl)propan-1-amine
MOLECULAR FORMULA: C8H19N
MOLECULAR WEIGHT: 129.24316
SMILES: CC(C)CNCC(C)C
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Product OPENEYE NAME: 1-(2-hydroxypropylamino)propan-2-ol
CAS Name: 1-(2-hydroxypropylamino)-2-propanol
IUPAC NAME: 1-(2-hydroxypropylamino)propan-2-ol
SYSTEMATIC NAME: 1-(2-oxidanylpropylamino)propan-2-ol
MOLECULAR FORMULA: C6H15NO2
MOLECULAR WEIGHT: 133.1888
SMILES: CC(CNCC(C)O)O
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Product OPENEYE NAME: 1-(2-hydroxypropoxy)propan-2-ol
CAS Name: 1-(2-hydroxypropoxy)-2-propanol
IUPAC NAME: 1-(2-hydroxypropoxy)propan-2-ol
SYSTEMATIC NAME: 1-(2-oxidanylpropoxy)propan-2-ol
MOLECULAR FORMULA: C6H14O3
MOLECULAR WEIGHT: 134.17356
SMILES: CC(COCC(C)O)O
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Product OPENEYE NAME: 2-(carboxymethoxy)acetic acid
CAS Name: 2-(carboxymethoxy)acetic acid
IUPAC NAME: 2-(carboxymethoxy)acetic acid
SYSTEMATIC NAME: 2-(2-hydroxy-2-oxoethyloxy)ethanoic acid
MOLECULAR FORMULA: C4H6O5
MOLECULAR WEIGHT: 134.08744
SMILES: C(C(=O)O)OCC(=O)O
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