Product OPENEYE NAME: 7-hydroxy-3,7-dimethyl-octanal
CAS Name: 7-hydroxy-3,7-dimethyloctanal
IUPAC NAME: 7-hydroxy-3,7-dimethyloctanal
SYSTEMATIC NAME: 3,7-dimethyl-7-oxidanyl-octanal
MOLECULAR FORMULA: C10H20O2
MOLECULAR WEIGHT: 172.2646
SMILES: CC(CCCC(C)(C)O)CC=O
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Product OPENEYE NAME: 1,3-dibromobutane
CAS Name: 1,3-dibromobutane
IUPAC NAME: 1,3-dibromobutane
SYSTEMATIC NAME: 1,3-bis(bromanyl)butane
MOLECULAR FORMULA: C4H8Br2
MOLECULAR WEIGHT: 215.91432
SMILES: CC(CCBr)Br
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Product OPENEYE NAME: 2-bromopentane
CAS Name: 2-bromopentane
IUPAC NAME: 2-bromopentane
SYSTEMATIC NAME: 2-bromanylpentane
MOLECULAR FORMULA: C5H11Br
MOLECULAR WEIGHT: 151.04484
SMILES: CCCC(C)Br
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Product OPENEYE NAME: 1-bromo-3-methyl-butane
CAS Name: 1-bromo-3-methylbutane
IUPAC NAME: 1-bromo-3-methylbutane
SYSTEMATIC NAME: 1-bromanyl-3-methyl-butane
MOLECULAR FORMULA: C5H11Br
MOLECULAR WEIGHT: 151.04484
SMILES: CC(C)CCBr
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Product OPENEYE NAME: 2-methylpentane
CAS Name: 2-methylpentane
IUPAC NAME: 2-methylpentane
SYSTEMATIC NAME: 2-methylpentane
MOLECULAR FORMULA: C6H14
MOLECULAR WEIGHT: 86.17536
SMILES: CCCC(C)C
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Product OPENEYE NAME: 1-chloro-3-methyl-butane
CAS Name: 1-chloro-3-methylbutane
IUPAC NAME: 1-chloro-3-methylbutane
SYSTEMATIC NAME: 1-chloranyl-3-methyl-butane
MOLECULAR FORMULA: C5H11Cl
MOLECULAR WEIGHT: 106.59384
SMILES: CC(C)CCCl
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Product OPENEYE NAME: 3-methylbutan-1-amine
CAS Name: 3-methyl-1-butanamine
IUPAC NAME: 3-methylbutan-1-amine
SYSTEMATIC NAME: 3-methylbutan-1-amine
MOLECULAR FORMULA: C5H13N
MOLECULAR WEIGHT: 87.16342
SMILES: CC(C)CCN
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Product OPENEYE NAME: pentan-2-one
CAS Name: 2-pentanone
IUPAC NAME: pentan-2-one
SYSTEMATIC NAME: pentan-2-one
MOLECULAR FORMULA: C5H10O
MOLECULAR WEIGHT: 86.1323
SMILES: CCCC(=O)C
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Product OPENEYE NAME: butane-1,3-diol
CAS Name: butane-1,3-diol
IUPAC NAME: butane-1,3-diol
SYSTEMATIC NAME: butane-1,3-diol
MOLECULAR FORMULA: C4H10O2
MOLECULAR WEIGHT: 90.121
SMILES: CC(CCO)O
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Product OPENEYE NAME: 3-hydroxybutanal
CAS Name: 3-hydroxybutanal
IUPAC NAME: 3-hydroxybutanal
SYSTEMATIC NAME: 3-oxidanylbutanal
MOLECULAR FORMULA: C4H8O2
MOLECULAR WEIGHT: 88.10512
SMILES: CC(CC=O)O
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Product OPENEYE NAME: 2-cyanoacetamide
CAS Name: 2-cyanoacetamide
IUPAC NAME: 2-cyanoacetamide
SYSTEMATIC NAME: 2-cyanoethanamide
MOLECULAR FORMULA: C3H4N2O
MOLECULAR WEIGHT: 84.07666
SMILES: C(C#N)C(=O)N
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Product OPENEYE NAME: 3-chloropropanoic acid
CAS Name: 3-chloropropanoic acid
IUPAC NAME: 3-chloropropanoic acid
SYSTEMATIC NAME: 3-chloranylpropanoic acid
MOLECULAR FORMULA: C3H5ClO2
MOLECULAR WEIGHT: 108.5236
SMILES: C(CCl)C(=O)O
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Product OPENEYE NAME: 1-methoxypropan-2-ol
CAS Name: 1-methoxy-2-propanol
IUPAC NAME: 1-methoxypropan-2-ol
SYSTEMATIC NAME: 1-methoxypropan-2-ol
MOLECULAR FORMULA: C4H10O2
MOLECULAR WEIGHT: 90.121
SMILES: CC(COC)O
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Product OPENEYE NAME: 2-chloro-N,N-dimethyl-ethanamine
CAS Name: 2-chloro-N,N-dimethylethanamine
IUPAC NAME: 2-chloro-N,N-dimethylethanamine
SYSTEMATIC NAME: 2-chloranyl-N,N-dimethyl-ethanamine
MOLECULAR FORMULA: C4H10ClN
MOLECULAR WEIGHT: 107.5819
SMILES: CN(C)CCCl
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Product OPENEYE NAME: 2-(dimethylamino)ethanol
CAS Name: 2-(dimethylamino)ethanol
IUPAC NAME: 2-(dimethylamino)ethanol
SYSTEMATIC NAME: 2-(dimethylamino)ethanol
MOLECULAR FORMULA: C4H11NO
MOLECULAR WEIGHT: 89.13624
SMILES: CN(C)CCO
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Product OPENEYE NAME: 1-nitropropane
CAS Name: 1-nitropropane
IUPAC NAME: 1-nitropropane
SYSTEMATIC NAME: 1-nitropropane
MOLECULAR FORMULA: C3H7NO2
MOLECULAR WEIGHT: 89.09318
SMILES: CCC[N+](=O)[O-]
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Product OPENEYE NAME: vinyl acetate
CAS Name: acetic acid ethenyl ester
IUPAC NAME: ethenyl acetate
SYSTEMATIC NAME: ethenyl ethanoate
MOLECULAR FORMULA: C4H6O2
MOLECULAR WEIGHT: 86.08924
SMILES: CC(=O)OC=C
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Product OPENEYE NAME: acetic acid; methylmercury
CAS Name: acetic acid; methylmercury
IUPAC NAME: acetic acid; methylmercury
SYSTEMATIC NAME: ethanoic acid; methylmercury
MOLECULAR FORMULA: C3H7HgO2
MOLECULAR WEIGHT: 275.67648
SMILES: CC(=O)O.C[Hg]
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