Product OPENEYE NAME: 6-fluorohexanal
CAS Name: 6-fluorohexanal
IUPAC NAME: 6-fluorohexanal
SYSTEMATIC NAME: 6-fluoranylhexanal
MOLECULAR FORMULA: C6H11FO
MOLECULAR WEIGHT: 118.149343
SMILES: C(CCC=O)CCF
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Product OPENEYE NAME: 1-fluoro-5-methoxy-pentane
CAS Name: 1-fluoro-5-methoxypentane
IUPAC NAME: 1-fluoro-5-methoxypentane
SYSTEMATIC NAME: 1-fluoranyl-5-methoxy-pentane
MOLECULAR FORMULA: C6H13FO
MOLECULAR WEIGHT: 120.165223
SMILES: COCCCCCF
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Product OPENEYE NAME: 2-[2-(2-fluoroethoxy)ethoxy]ethanol
CAS Name: 2-[2-(2-fluoroethoxy)ethoxy]ethanol
IUPAC NAME: 2-[2-(2-fluoroethoxy)ethoxy]ethanol
SYSTEMATIC NAME: 2-[2-(2-fluoranylethoxy)ethoxy]ethanol
MOLECULAR FORMULA: C6H13FO3
MOLECULAR WEIGHT: 152.164023
SMILES: C(COCCOCCF)O
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Product OPENEYE NAME: 2,2,2-trifluoroethanamine hydrochloride
CAS Name: 2,2,2-trifluoroethanamine hydrochloride
IUPAC NAME: 2,2,2-trifluoroethanamine hydrochloride
SYSTEMATIC NAME: 2,2,2-tris(fluoranyl)ethanamine hydrochloride
MOLECULAR FORMULA: C2H5ClF3N
MOLECULAR WEIGHT: 135.51601
SMILES: C(C(F)(F)F)N.Cl
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Product OPENEYE NAME: 2,2,2-trifluoroethanamine
CAS Name: 2,2,2-trifluoroethanamine
IUPAC NAME: 2,2,2-trifluoroethanamine
SYSTEMATIC NAME: 2,2,2-tris(fluoranyl)ethanamine
MOLECULAR FORMULA: C2H4F3N
MOLECULAR WEIGHT: 99.05507
SMILES: C(C(F)(F)F)N
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Product OPENEYE NAME: 1,1,1-trifluoropropan-2-ol
CAS Name: 1,1,1-trifluoro-2-propanol
IUPAC NAME: 1,1,1-trifluoropropan-2-ol
SYSTEMATIC NAME: 1,1,1-tris(fluoranyl)propan-2-ol
MOLECULAR FORMULA: C3H5F3O
MOLECULAR WEIGHT: 114.06641
SMILES: CC(C(F)(F)F)O
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Product OPENEYE NAME: 1,1-dichloro-1,2,2,2-tetrafluoro-ethane
CAS Name: 1,1-dichloro-1,2,2,2-tetrafluoroethane
IUPAC NAME: 1,1-dichloro-1,2,2,2-tetrafluoroethane
SYSTEMATIC NAME: 1,1-bis(chloranyl)-1,2,2,2-tetrakis(fluoranyl)ethane
MOLECULAR FORMULA: C2Cl2F4
MOLECULAR WEIGHT: 170.921013
SMILES: C(C(F)(Cl)Cl)(F)(F)F
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Product OPENEYE NAME: 2,2,3,3,4,4,4-heptafluorobutan-1-ol
CAS Name: 2,2,3,3,4,4,4-heptafluoro-1-butanol
IUPAC NAME: 2,2,3,3,4,4,4-heptafluorobutan-1-ol
SYSTEMATIC NAME: 2,2,3,3,4,4,4-heptakis(fluoranyl)butan-1-ol
MOLECULAR FORMULA: C4H3F7O
MOLECULAR WEIGHT: 200.054842
SMILES: C(C(C(C(F)(F)F)(F)F)(F)F)O
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Product OPENEYE NAME: 2,2,3,3,4,4,4-heptafluorobutanoic acid
CAS Name: 2,2,3,3,4,4,4-heptafluorobutanoic acid
IUPAC NAME: 2,2,3,3,4,4,4-heptafluorobutanoic acid
SYSTEMATIC NAME: 2,2,3,3,4,4,4-heptakis(fluoranyl)butanoic acid
MOLECULAR FORMULA: C4HF7O2
MOLECULAR WEIGHT: 214.038362
SMILES: C(=O)(C(C(C(F)(F)F)(F)F)(F)F)O
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Product OPENEYE NAME: 1,1,1,2,2,3,3,4,4,5,5,6,6,7,7-pentadecafluoroheptane
CAS Name: 1,1,1,2,2,3,3,4,4,5,5,6,6,7,7-pentadecafluoroheptane
IUPAC NAME: 1,1,1,2,2,3,3,4,4,5,5,6,6,7,7-pentadecafluoroheptane
SYSTEMATIC NAME: 1,1,1,2,2,3,3,4,4,5,5,6,6,7,7-pentadecakis(fluoranyl)heptane
MOLECULAR FORMULA: C7HF15
MOLECULAR WEIGHT: 370.058888
SMILES: C(C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F
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Product OPENEYE NAME: 2,2,3,3,4,4,5,5,6,6,7,7,8,8,9,9-hexadecafluorononan-1-ol
CAS Name: 2,2,3,3,4,4,5,5,6,6,7,7,8,8,9,9-hexadecafluoro-1-nonanol
IUPAC NAME: 2,2,3,3,4,4,5,5,6,6,7,7,8,8,9,9-hexadecafluorononan-1-ol
SYSTEMATIC NAME: 2,2,3,3,4,4,5,5,6,6,7,7,8,8,9,9-hexadecakis(fluoranyl)nonan-1-ol
MOLECULAR FORMULA: C9H4F16O
MOLECULAR WEIGHT: 432.101911
SMILES: C(C(C(C(C(C(C(C(C(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)O
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Product OPENEYE NAME: 1,1,1,2,2,3,3-heptafluoro-4-isocyanato-butane
CAS Name: 1,1,1,2,2,3,3-heptafluoro-4-isocyanatobutane
IUPAC NAME: 1,1,1,2,2,3,3-heptafluoro-4-isocyanatobutane
SYSTEMATIC NAME: 1,1,1,2,2,3,3-heptakis(fluoranyl)-4-isocyanato-butane
MOLECULAR FORMULA: C5H2F7NO
MOLECULAR WEIGHT: 225.064302
SMILES: C(C(C(C(F)(F)F)(F)F)(F)F)N=C=O
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Product OPENEYE NAME: 17-acetyl-9-fluoro-11-hydroxy-6,10,13-trimethyl-2,6,7,8,11,12,14,15,16,17-decahydro-1H-cyclopenta[a]phenanthren-3-one
CAS Name: 17-acetyl-9-fluoro-11-hydroxy-6,10,13-trimethyl-2,6,7,8,11,12,14,15,16,17-decahydro-1H-cyclopenta[a]phenanthren-3-one
IUPAC NAME: 17-acetyl-9-fluoro-11-hydroxy-6,10,13-trimethyl-2,6,7,8,11,12,14,15,16,17-decahydro-1H-cyclopenta[a]phenanthren-3-one
SYSTEMATIC NAME: 17-ethanoyl-9-fluoranyl-6,10,13-trimethyl-11-oxidanyl-2,6,7,8,11,12,14,15,16,17-decahydro-1H-cyclopenta[a]phenanthren-3-one
MOLECULAR FORMULA: C22H31FO3
MOLECULAR WEIGHT: 362.478143
SMILES: CC1CC2C3CCC(C3(CC(C2(C4(C1=CC(=O)CC4)C)F)O)C)C(=O)C
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Product OPENEYE NAME: (8S,9R,10S,11S,13S,14S,16S,17R)-9-fluoro-11,17-dihydroxy-17-(2-hydroxyacetyl)-10,13,16-trimethyl-6,7,8,11,12,14,15,16-octahydrocyclopenta[a]phenanthren-3-one
CAS Name: (8S,9R,10S,11S,13S,14S,16S,17R)-9-fluoro-11,17-dihydroxy-17-(2-hydroxy-1-oxoethyl)-10,13,16-trimethyl-6,7,8,11,12,14,15,16-octahydrocyclopenta[a]phenanthren-3-one
IUPAC NAME: (8S,9R,10S,11S,13S,14S,16S,17R)-9-fluoro-11,17-dihydroxy-17-(2-hydroxyacetyl)-10,13,16-trimethyl-6,7,8,11,12,14,15,16-octahydrocyclopenta[a]phenanthren-3-one
SYSTEMATIC NAME: (8S,9R,10S,11S,13S,14S,16S,17R)-9-fluoranyl-10,13,16-trimethyl-11,17-bis(oxidanyl)-17-(2-oxidanylethanoyl)-6,7,8,11,12,14,15,16-octahydrocyclopenta[a]phenanthren-3-one
MOLECULAR FORMULA: C22H29FO5
MOLECULAR WEIGHT: 392.461063
SMILES: C[C@H]1C[C@H]2[C@@H]3CCC4=CC(=O)C=C[C@@]4([C@]3([C@H](C[C@@]2([C@]1(C(=O)CO)O)C)O)F)C
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Product OPENEYE NAME: methyl 2,2,3,3,3-pentafluoropropanoate
CAS Name: 2,2,3,3,3-pentafluoropropanoic acid methyl ester
IUPAC NAME: methyl 2,2,3,3,3-pentafluoropropanoate
SYSTEMATIC NAME: methyl 2,2,3,3,3-pentakis(fluoranyl)propanoate
MOLECULAR FORMULA: C4H3F5O2
MOLECULAR WEIGHT: 178.057436
SMILES: COC(=O)C(C(F)(F)F)(F)F
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Product OPENEYE NAME: 5-(3-chlorophenyl)-5-ethyl-hexahydropyrimidine-2,4,6-trione
CAS Name: 5-(3-chlorophenyl)-5-ethyl-1,3-diazinane-2,4,6-trione
IUPAC NAME: 5-(3-chlorophenyl)-5-ethyl-1,3-diazinane-2,4,6-trione
SYSTEMATIC NAME: 5-(3-chlorophenyl)-5-ethyl-1,3-diazinane-2,4,6-trione
MOLECULAR FORMULA: C12H11ClN2O3
MOLECULAR WEIGHT: 266.68034
SMILES: CCC1(C(=O)NC(=O)NC1=O)C2=CC(=CC=C2)Cl
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Product OPENEYE NAME: 5-ethyl-5-(4-hydroxyphenyl)hexahydropyrimidine-2,4,6-trione
CAS Name: 5-ethyl-5-(4-hydroxyphenyl)-1,3-diazinane-2,4,6-trione
IUPAC NAME: 5-ethyl-5-(4-hydroxyphenyl)-1,3-diazinane-2,4,6-trione
SYSTEMATIC NAME: 5-ethyl-5-(4-hydroxyphenyl)-1,3-diazinane-2,4,6-trione
MOLECULAR FORMULA: C12H12N2O4
MOLECULAR WEIGHT: 248.23468
SMILES: CCC1(C(=O)NC(=O)NC1=O)C2=CC=C(C=C2)O
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Product OPENEYE NAME: fluoro(triphenyl)stannane
CAS Name: fluoro(triphenyl)stannane
IUPAC NAME: fluoro(triphenyl)stannane
SYSTEMATIC NAME: fluoranyl(triphenyl)stannane
MOLECULAR FORMULA: C18H15FSn
MOLECULAR WEIGHT: 369.020103
SMILES: C1=CC=C(C=C1)[Sn](C2=CC=CC=C2)(C3=CC=CC=C3)F
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Product OPENEYE NAME:
CAS Name:
IUPAC NAME:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C70H76N10O16
MOLECULAR WEIGHT: 1313.40984
SMILES: C[C@@]1(C(=O)N2[C@H](C(=O)N3CCC[C@H]3[C@@]2(O1)O)CC4=CC=CC=C4)NC(=O)[C@H]5CN([C@@H]6CC7=CNC8=CC=CC(=C78)C6=C5)C.C[C@@]1(C(=O)N2[C@H](C(=O)N3CCC[C@H]3[C@@]2(O1)O)CC4=CC=CC=C4)NC(=O)[C@H]5CN([C@@H]6CC7=CNC8=CC=CC(=C78)C6=C5)C.[C@@H]([C@H](C(=O)O)O)(C(=O)O)O
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Product OPENEYE NAME: 2,2-difluoroacetic acid
CAS Name: 2,2-difluoroacetic acid
IUPAC NAME: 2,2-difluoroacetic acid
SYSTEMATIC NAME: 2,2-bis(fluoranyl)ethanoic acid
MOLECULAR FORMULA: C2H2F2O2
MOLECULAR WEIGHT: 96.032886
SMILES: C(C(=O)O)(F)F
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Product OPENEYE NAME: 2-(trifluoromethyl)prop-2-enenitrile
CAS Name: 2-(trifluoromethyl)-2-propenenitrile
IUPAC NAME: 2-(trifluoromethyl)prop-2-enenitrile
SYSTEMATIC NAME: 2-(trifluoromethyl)prop-2-enenitrile
MOLECULAR FORMULA: C4H2F3N
MOLECULAR WEIGHT: 121.06059
SMILES: C=C(C#N)C(F)(F)F
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Product OPENEYE NAME: 1,2-dichloro-3,3-difluoro-butane
CAS Name: 1,2-dichloro-3,3-difluorobutane
IUPAC NAME: 1,2-dichloro-3,3-difluorobutane
SYSTEMATIC NAME: 1,2-bis(chloranyl)-3,3-bis(fluoranyl)butane
MOLECULAR FORMULA: C4H6Cl2F2
MOLECULAR WEIGHT: 162.993246
SMILES: CC(C(CCl)Cl)(F)F
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Product OPENEYE NAME: 10,13-dimethyl-1,2,6,7,8,9,12,14,15,16-decahydrocyclopenta[a]phenanthrene-3,11,17-trione
CAS Name: 10,13-dimethyl-1,2,6,7,8,9,12,14,15,16-decahydrocyclopenta[a]phenanthrene-3,11,17-trione
IUPAC NAME: 10,13-dimethyl-1,2,6,7,8,9,12,14,15,16-decahydrocyclopenta[a]phenanthrene-3,11,17-trione
SYSTEMATIC NAME: 10,13-dimethyl-1,2,6,7,8,9,12,14,15,16-decahydrocyclopenta[a]phenanthrene-3,11,17-trione
MOLECULAR FORMULA: C19H24O3
MOLECULAR WEIGHT: 300.39206
SMILES: CC12CCC(=O)C=C1CCC3C2C(=O)CC4(C3CCC4=O)C
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