Product OPENEYE NAME: 2-(butylamino)-1-(3-fluorophenyl)ethanol
CAS Name: 2-(butylamino)-1-(3-fluorophenyl)ethanol
IUPAC NAME: 2-(butylamino)-1-(3-fluorophenyl)ethanol
SYSTEMATIC NAME: 2-(butylamino)-1-(3-fluorophenyl)ethanol
MOLECULAR FORMULA: C12H18FNO
MOLECULAR WEIGHT: 211.275823
SMILES: CCCCNCC(C1=CC(=CC=C1)F)O
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Product OPENEYE NAME: 2-[2-(methylamino)propyl]phenol
CAS Name: 2-[2-(methylamino)propyl]phenol
IUPAC NAME: 2-[2-(methylamino)propyl]phenol
SYSTEMATIC NAME: 2-[2-(methylamino)propyl]phenol
MOLECULAR FORMULA: C10H15NO
MOLECULAR WEIGHT: 165.2322
SMILES: CC(CC1=CC=CC=C1O)NC
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Product OPENEYE NAME: allyl benzoate
CAS Name: benzoic acid prop-2-enyl ester
IUPAC NAME: prop-2-enyl benzoate
SYSTEMATIC NAME: prop-2-enyl benzoate
MOLECULAR FORMULA: C10H10O2
MOLECULAR WEIGHT: 162.1852
SMILES: C=CCOC(=O)C1=CC=CC=C1
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Product OPENEYE NAME: mercuric dibenzoate
CAS Name: mercury(2+) dibenzoate
IUPAC NAME: mercury(2+) dibenzoate
SYSTEMATIC NAME: mercury(2+) dibenzoate
MOLECULAR FORMULA: C14H10HgO4
MOLECULAR WEIGHT: 442.8168
SMILES: C1=CC=C(C=C1)C(=O)[O-].C1=CC=C(C=C1)C(=O)[O-].[Hg+2]
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Product OPENEYE NAME: 5-fluoropentyl benzoate
CAS Name: benzoic acid 5-fluoropentyl ester
IUPAC NAME: 5-fluoropentyl benzoate
SYSTEMATIC NAME: 5-fluoranylpentyl benzoate
MOLECULAR FORMULA: C12H15FO2
MOLECULAR WEIGHT: 210.244703
SMILES: C1=CC=C(C=C1)C(=O)OCCCCCF
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Product OPENEYE NAME: butyl furan-2-carboxylate
CAS Name: 2-furancarboxylic acid butyl ester
IUPAC NAME: butyl furan-2-carboxylate
SYSTEMATIC NAME: butyl furan-2-carboxylate
MOLECULAR FORMULA: C9H12O3
MOLECULAR WEIGHT: 168.18978
SMILES: CCCCOC(=O)C1=CC=CO1
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Product OPENEYE NAME: 3,4-dimethylhexane
CAS Name: 3,4-dimethylhexane
IUPAC NAME: 3,4-dimethylhexane
SYSTEMATIC NAME: 3,4-dimethylhexane
MOLECULAR FORMULA: C8H18
MOLECULAR WEIGHT: 114.22852
SMILES: CCC(C)C(C)CC
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Product OPENEYE NAME: dipotassium oxalate
CAS Name: dipotassium oxalate
IUPAC NAME: dipotassium oxalate
SYSTEMATIC NAME: dipotassium ethanedioate
MOLECULAR FORMULA: C2K2O4
MOLECULAR WEIGHT: 166.2156
SMILES: C(=O)(C(=O)[O-])[O-].[K+].[K+]
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Product OPENEYE NAME: 1,2-dibromobenzene
CAS Name: 1,2-dibromobenzene
IUPAC NAME: 1,2-dibromobenzene
SYSTEMATIC NAME: 1,2-bis(bromanyl)benzene
MOLECULAR FORMULA: C6H4Br2
MOLECULAR WEIGHT: 235.90396
SMILES: C1=CC=C(C(=C1)Br)Br
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Product OPENEYE NAME: 1-bromo-2-iodo-benzene
CAS Name: 1-bromo-2-iodobenzene
IUPAC NAME: 1-bromo-2-iodobenzene
SYSTEMATIC NAME: 1-bromanyl-2-iodanyl-benzene
MOLECULAR FORMULA: C6H4BrI
MOLECULAR WEIGHT: 282.90443
SMILES: C1=CC=C(C(=C1)Br)I
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Product OPENEYE NAME: 1,2-dimethylcyclohexane
CAS Name: 1,2-dimethylcyclohexane
IUPAC NAME: 1,2-dimethylcyclohexane
SYSTEMATIC NAME: 1,2-dimethylcyclohexane
MOLECULAR FORMULA: C8H16
MOLECULAR WEIGHT: 112.21264
SMILES: CC1CCCCC1C
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Product OPENEYE NAME: 3,4-dimethylpyridine
CAS Name: 3,4-dimethylpyridine
IUPAC NAME: 3,4-dimethylpyridine
SYSTEMATIC NAME: 3,4-dimethylpyridine
MOLECULAR FORMULA: C7H9N
MOLECULAR WEIGHT: 107.15306
SMILES: CC1=C(C=NC=C1)C
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Product OPENEYE NAME: 2-methylcyclohexanol
CAS Name: 2-methyl-1-cyclohexanol
IUPAC NAME: 2-methylcyclohexan-1-ol
SYSTEMATIC NAME: 2-methylcyclohexan-1-ol
MOLECULAR FORMULA: C7H14O
MOLECULAR WEIGHT: 114.18546
SMILES: CC1CCCCC1O
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Product OPENEYE NAME: 2-methylcyclohexanone
CAS Name: 2-methyl-1-cyclohexanone
IUPAC NAME: 2-methylcyclohexan-1-one
SYSTEMATIC NAME: 2-methylcyclohexan-1-one
MOLECULAR FORMULA: C7H12O
MOLECULAR WEIGHT: 112.16958
SMILES: CC1CCCCC1=O
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