Tuesday, August 2, 2011

All Chemical Compounds Information




Product OPENEYE NAME: fluoromethylbenzene
CAS Name: fluoromethylbenzene
IUPAC NAME: fluoromethylbenzene
SYSTEMATIC NAME: fluoranylmethylbenzene
MOLECULAR FORMULA: C7H7F
MOLECULAR WEIGHT: 110.128883
SMILES: C1=CC=C(C=C1)CF
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Product OPENEYE NAME: 4-(3,5-difluorophenyl)azo-N,N-dimethyl-aniline
CAS Name: 4-(3,5-difluorophenyl)azo-N,N-dimethylaniline
IUPAC NAME: 4-[(3,5-difluorophenyl)diazenyl]-N,N-dimethylaniline
SYSTEMATIC NAME: 4-[[3,5-bis(fluoranyl)phenyl]diazenyl]-N,N-dimethyl-aniline
MOLECULAR FORMULA: C14H13F2N3
MOLECULAR WEIGHT: 261.269926
SMILES: CN(C)C1=CC=C(C=C1)N=NC2=CC(=CC(=C2)F)F
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Product OPENEYE NAME: N-(4-bromophenyl)-2-fluoro-acetamide
CAS Name: N-(4-bromophenyl)-2-fluoroacetamide
IUPAC NAME: N-(4-bromophenyl)-2-fluoroacetamide
SYSTEMATIC NAME: N-(4-bromophenyl)-2-fluoranyl-ethanamide
MOLECULAR FORMULA: C8H7BrFNO
MOLECULAR WEIGHT: 232.049683
SMILES: C1=CC(=CC=C1NC(=O)CF)Br
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Product OPENEYE NAME: N-(3-fluorophenyl)acetamide
CAS Name: N-(3-fluorophenyl)acetamide
IUPAC NAME: N-(3-fluorophenyl)acetamide
SYSTEMATIC NAME: N-(3-fluorophenyl)ethanamide
MOLECULAR FORMULA: C8H8FNO
MOLECULAR WEIGHT: 153.153623
SMILES: CC(=O)NC1=CC(=CC=C1)F
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Product OPENEYE NAME: N-[3-(trifluoromethyl)phenyl]acetamide
CAS Name: N-[3-(trifluoromethyl)phenyl]acetamide
IUPAC NAME: N-[3-(trifluoromethyl)phenyl]acetamide
SYSTEMATIC NAME: N-[3-(trifluoromethyl)phenyl]ethanamide
MOLECULAR FORMULA: C9H8F3NO
MOLECULAR WEIGHT: 203.16113
SMILES: CC(=O)NC1=CC=CC(=C1)C(F)(F)F
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Product OPENEYE NAME: N-(2,2,2-trifluoroethyl)aniline
CAS Name: N-(2,2,2-trifluoroethyl)aniline
IUPAC NAME: N-(2,2,2-trifluoroethyl)aniline
SYSTEMATIC NAME: N-[2,2,2-tris(fluoranyl)ethyl]aniline
MOLECULAR FORMULA: C8H8F3N
MOLECULAR WEIGHT: 175.15103
SMILES: C1=CC=C(C=C1)NCC(F)(F)F
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Product OPENEYE NAME: 4-(2,4-difluorophenyl)azo-N,N-dimethyl-aniline
CAS Name: 4-(2,4-difluorophenyl)azo-N,N-dimethylaniline
IUPAC NAME: 4-[(2,4-difluorophenyl)diazenyl]-N,N-dimethylaniline
SYSTEMATIC NAME: 4-[[2,4-bis(fluoranyl)phenyl]diazenyl]-N,N-dimethyl-aniline
MOLECULAR FORMULA: C14H13F2N3
MOLECULAR WEIGHT: 261.269926
SMILES: CN(C)C1=CC=C(C=C1)N=NC2=C(C=C(C=C2)F)F
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Product OPENEYE NAME: 4-(3,4-difluorophenyl)azo-N,N-dimethyl-aniline
CAS Name: 4-(3,4-difluorophenyl)azo-N,N-dimethylaniline
IUPAC NAME: 4-[(3,4-difluorophenyl)diazenyl]-N,N-dimethylaniline
SYSTEMATIC NAME: 4-[[3,4-bis(fluoranyl)phenyl]diazenyl]-N,N-dimethyl-aniline
MOLECULAR FORMULA: C14H13F2N3
MOLECULAR WEIGHT: 261.269926
SMILES: CN(C)C1=CC=C(C=C1)N=NC2=CC(=C(C=C2)F)F
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Product OPENEYE NAME: 2-(diethylamino)ethyl 2-(4-fluorophenoxy)acetate hydrochloride
CAS Name: 2-(4-fluorophenoxy)acetic acid 2-(diethylamino)ethyl ester hydrochloride
IUPAC NAME: 2-(diethylamino)ethyl 2-(4-fluorophenoxy)acetate hydrochloride
SYSTEMATIC NAME: 2-(diethylamino)ethyl 2-(4-fluoranylphenoxy)ethanoate hydrochloride
MOLECULAR FORMULA: C14H21ClFNO3
MOLECULAR WEIGHT: 305.772843
SMILES: CCN(CC)CCOC(=O)COC1=CC=C(C=C1)F.Cl
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Product OPENEYE NAME: 2-(diethylamino)ethyl 2-(4-fluorophenoxy)acetate
CAS Name: 2-(4-fluorophenoxy)acetic acid 2-(diethylamino)ethyl ester
IUPAC NAME: 2-(diethylamino)ethyl 2-(4-fluorophenoxy)acetate
SYSTEMATIC NAME: 2-(diethylamino)ethyl 2-(4-fluoranylphenoxy)ethanoate
MOLECULAR FORMULA: C14H20FNO3
MOLECULAR WEIGHT: 269.311903
SMILES: CCN(CC)CCOC(=O)COC1=CC=C(C=C1)F
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Product OPENEYE NAME: N-(4-fluorophenyl)acetamide
CAS Name: N-(4-fluorophenyl)acetamide
IUPAC NAME: N-(4-fluorophenyl)acetamide
SYSTEMATIC NAME: N-(4-fluorophenyl)ethanamide
MOLECULAR FORMULA: C8H8FNO
MOLECULAR WEIGHT: 153.153623
SMILES: CC(=O)NC1=CC=C(C=C1)F
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Product OPENEYE NAME: 1-(chloromethyl)-4-fluoro-benzene
CAS Name: 1-(chloromethyl)-4-fluorobenzene
IUPAC NAME: 1-(chloromethyl)-4-fluorobenzene
SYSTEMATIC NAME: 1-(chloromethyl)-4-fluoranyl-benzene
MOLECULAR FORMULA: C7H6ClF
MOLECULAR WEIGHT: 144.573943
SMILES: C1=CC(=CC=C1CCl)F
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Product OPENEYE NAME: 1-fluoro-4-methyl-benzene
CAS Name: 1-fluoro-4-methylbenzene
IUPAC NAME: 1-fluoro-4-methylbenzene
SYSTEMATIC NAME: 1-fluoranyl-4-methyl-benzene
MOLECULAR FORMULA: C7H7F
MOLECULAR WEIGHT: 110.128883
SMILES: CC1=CC=C(C=C1)F
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Product OPENEYE NAME: 1-chloro-4-fluoro-benzene
CAS Name: 1-chloro-4-fluorobenzene
IUPAC NAME: 1-chloro-4-fluorobenzene
SYSTEMATIC NAME: 1-chloranyl-4-fluoranyl-benzene
MOLECULAR FORMULA: C6H4ClF
MOLECULAR WEIGHT: 130.547363
SMILES: C1=CC(=CC=C1F)Cl
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Product OPENEYE NAME: 1-fluoro-4-iodo-benzene
CAS Name: 1-fluoro-4-iodobenzene
IUPAC NAME: 1-fluoro-4-iodobenzene
SYSTEMATIC NAME: 1-fluoranyl-4-iodanyl-benzene
MOLECULAR FORMULA: C6H4FI
MOLECULAR WEIGHT: 221.998833
SMILES: C1=CC(=CC=C1F)I
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Product OPENEYE NAME: 1-fluoro-3-methyl-benzene
CAS Name: 1-fluoro-3-methylbenzene
IUPAC NAME: 1-fluoro-3-methylbenzene
SYSTEMATIC NAME: 1-fluoranyl-3-methyl-benzene
MOLECULAR FORMULA: C7H7F
MOLECULAR WEIGHT: 110.128883
SMILES: CC1=CC(=CC=C1)F
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Product OPENEYE NAME: ethyl 12-fluoro-3-oxo-dodecanoate
CAS Name: 12-fluoro-3-oxododecanoic acid ethyl ester
IUPAC NAME: ethyl 12-fluoro-3-oxododecanoate
SYSTEMATIC NAME: ethyl 12-fluoranyl-3-oxidanylidene-dodecanoate
MOLECULAR FORMULA: C14H25FO3
MOLECULAR WEIGHT: 260.344903
SMILES: CCOC(=O)CC(=O)CCCCCCCCCF
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Product OPENEYE NAME: 2,2,2-trifluoroethyl 2-methylprop-2-enoate
CAS Name: 2-methyl-2-propenoic acid 2,2,2-trifluoroethyl ester
IUPAC NAME: 2,2,2-trifluoroethyl 2-methylprop-2-enoate
SYSTEMATIC NAME: 2,2,2-tris(fluoranyl)ethyl 2-methylprop-2-enoate
MOLECULAR FORMULA: C6H7F3O2
MOLECULAR WEIGHT: 168.11379
SMILES: CC(=C)C(=O)OCC(F)(F)F
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Product OPENEYE NAME: ethylsulfanylethane
CAS Name: (ethylthio)ethane
IUPAC NAME: ethylsulfanylethane
SYSTEMATIC NAME: ethylsulfanylethane
MOLECULAR FORMULA: C4H10S
MOLECULAR WEIGHT: 90.1872
SMILES: CCSCC
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Product OPENEYE NAME: 3-aminopropanenitrile; but-2-enedioic acid
CAS Name: 3-aminopropanenitrile; but-2-enedioic acid
IUPAC NAME: 3-aminopropanenitrile; but-2-enedioic acid
SYSTEMATIC NAME: 3-azanylpropanenitrile; but-2-enedioic acid
MOLECULAR FORMULA: C7H10N2O4
MOLECULAR WEIGHT: 186.1653
SMILES: C(CN)C#N.C(=CC(=O)O)C(=O)O
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Product OPENEYE NAME: ethyl 10-fluorodecanoate
CAS Name: 10-fluorodecanoic acid ethyl ester
IUPAC NAME: ethyl 10-fluorodecanoate
SYSTEMATIC NAME: ethyl 10-fluoranyldecanoate
MOLECULAR FORMULA: C12H23FO2
MOLECULAR WEIGHT: 218.308223
SMILES: CCOC(=O)CCCCCCCCCF
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