Wednesday, August 10, 2011

All Chemical Compounds Information




Product OPENEYE NAME: 2,3,5-trimethylphenol
CAS Name: 2,3,5-trimethylphenol
IUPAC NAME: 2,3,5-trimethylphenol
SYSTEMATIC NAME: 2,3,5-trimethylphenol
MOLECULAR FORMULA: C9H12O
MOLECULAR WEIGHT: 136.19098
SMILES: CC1=CC(=C(C(=C1)O)C)C
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Product OPENEYE NAME: 2,6-dichloro-4-iodo-aniline
CAS Name: 2,6-dichloro-4-iodoaniline
IUPAC NAME: 2,6-dichloro-4-iodoaniline
SYSTEMATIC NAME: 2,6-bis(chloranyl)-4-iodanyl-aniline
MOLECULAR FORMULA: C6H4Cl2IN
MOLECULAR WEIGHT: 287.91313
SMILES: C1=C(C=C(C(=C1Cl)N)Cl)I
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Product OPENEYE NAME: 2,6-dichloro-1,4-benzoquinone
CAS Name: 2,6-dichlorocyclohexa-2,5-diene-1,4-dione
IUPAC NAME: 2,6-dichlorocyclohexa-2,5-diene-1,4-dione
SYSTEMATIC NAME: 2,6-bis(chloranyl)cyclohexa-2,5-diene-1,4-dione
MOLECULAR FORMULA: C6H2Cl2O2
MOLECULAR WEIGHT: 176.98488
SMILES: C1=C(C(=O)C(=CC1=O)Cl)Cl
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Product OPENEYE NAME: 2-chloro-N,N-dimethyl-aniline
CAS Name: 2-chloro-N,N-dimethylaniline
IUPAC NAME: 2-chloro-N,N-dimethylaniline
SYSTEMATIC NAME: 2-chloranyl-N,N-dimethyl-aniline
MOLECULAR FORMULA: C8H10ClN
MOLECULAR WEIGHT: 155.6247
SMILES: CN(C)C1=CC=CC=C1Cl
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Product OPENEYE NAME: 6-amino-2-hydroxy-cyclohepta-2,4,6-trien-1-one
CAS Name: 6-amino-2-hydroxy-1-cyclohepta-2,4,6-trienone
IUPAC NAME: 6-amino-2-hydroxycyclohepta-2,4,6-trien-1-one
SYSTEMATIC NAME: 6-azanyl-2-oxidanyl-cyclohepta-2,4,6-trien-1-one
MOLECULAR FORMULA: C7H7NO2
MOLECULAR WEIGHT: 137.13598
SMILES: C1=CC(=CC(=O)C(=C1)O)N
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Product OPENEYE NAME: 5-nitrofuran-2-carbaldehyde
CAS Name: 5-nitro-2-furancarboxaldehyde
IUPAC NAME: 5-nitrofuran-2-carbaldehyde
SYSTEMATIC NAME: 5-nitrofuran-2-carbaldehyde
MOLECULAR FORMULA: C5H3NO4
MOLECULAR WEIGHT: 141.08162
SMILES: C1=C(OC(=C1)[N+](=O)[O-])C=O
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Product OPENEYE NAME: 3-ethyl-5-methyl-phenol
CAS Name: 3-ethyl-5-methylphenol
IUPAC NAME: 3-ethyl-5-methylphenol
SYSTEMATIC NAME: 3-ethyl-5-methyl-phenol
MOLECULAR FORMULA: C9H12O
MOLECULAR WEIGHT: 136.19098
SMILES: CCC1=CC(=CC(=C1)C)O
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Product OPENEYE NAME: 2,4-dichloro-6-ethyl-1,3,5-triazine
CAS Name: 2,4-dichloro-6-ethyl-1,3,5-triazine
IUPAC NAME: 2,4-dichloro-6-ethyl-1,3,5-triazine
SYSTEMATIC NAME: 2,4-bis(chloranyl)-6-ethyl-1,3,5-triazine
MOLECULAR FORMULA: C5H5Cl2N3
MOLECULAR WEIGHT: 178.0193
SMILES: CCC1=NC(=NC(=N1)Cl)Cl
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Product OPENEYE NAME: 6-propyltetrahydropyran-2-one
CAS Name: 6-propyl-2-oxanone
IUPAC NAME: 6-propyloxan-2-one
SYSTEMATIC NAME: 6-propyloxan-2-one
MOLECULAR FORMULA: C8H14O2
MOLECULAR WEIGHT: 142.19556
SMILES: CCCC1CCCC(=O)O1
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