CAS RN: 387824-61-5
CAS Name: 3-(trifluoromethyl)-4-pyridinamine
OPENEYE Name: 3-(trifluoromethyl)pyridin-4-amine
IUPAC Name: 3-(trifluoromethyl)pyridin-4-amine
SYSTEMATIC NAME: 3-(trifluoromethyl)pyridin-4-amine
MOLECULAR FORMULA: C6H5F3N2
MOLECULAR WEIGHT: 162.11251
SMILES: C1=CN=CC(=C1N)C(F)(F)F
Structure:
CAS RN: 675602-89-8
CAS Name: 3,6-difluoro-4-(trifluoromethyl)-2-pyridinamine
OPENEYE Name: 3,6-difluoro-4-(trifluoromethyl)pyridin-2-amine
IUPAC Name: 3,6-difluoro-4-(trifluoromethyl)pyridin-2-amine
SYSTEMATIC NAME: 3,6-bis(fluoranyl)-4-(trifluoromethyl)pyridin-2-amine
MOLECULAR FORMULA: C6H3F5N2
MOLECULAR WEIGHT: 198.093436
SMILES: C1=C(C(=C(N=C1F)N)F)C(F)(F)F
Structure:
CAS RN: 31301-51-6
CAS Name: 2-chloro-5-fluoropyridine
OPENEYE Name: 2-chloro-5-fluoro-pyridine
IUPAC Name: 2-chloro-5-fluoropyridine
SYSTEMATIC NAME: 2-chloranyl-5-fluoranyl-pyridine
MOLECULAR FORMULA: C5H3ClFN
MOLECULAR WEIGHT: 131.535423
SMILES: C1=CC(=NC=C1F)Cl
Structure:
CAS RN: 72505-20-5
CAS Name: 3-fluorobenzenecarbothioamide
OPENEYE Name: 3-fluorobenzenecarbothioamide
IUPAC Name: 3-fluorobenzenecarbothioamide
SYSTEMATIC NAME: 3-fluoranylbenzenecarbothioamide
MOLECULAR FORMULA: C7H6FNS
MOLECULAR WEIGHT: 155.192643
SMILES: C1=CC(=CC(=C1)F)C(=S)N
Structure:
CAS RN: 66684-58-0
CAS Name: 1,2,3-trifluoro-5-nitrobenzene
OPENEYE Name: 1,2,3-trifluoro-5-nitro-benzene
IUPAC Name: 1,2,3-trifluoro-5-nitrobenzene
SYSTEMATIC NAME: 1,2,3-tris(fluoranyl)-5-nitro-benzene
MOLECULAR FORMULA: C6H2F3NO2
MOLECULAR WEIGHT: 177.08079
SMILES: C1=C(C=C(C(=C1F)F)F)[N+](=O)[O-]
Structure:
CAS RN: 34941-91-8
CAS Name: 2-chloro-4-fluoropyridine
OPENEYE Name: 2-chloro-4-fluoro-pyridine
IUPAC Name: 2-chloro-4-fluoropyridine
SYSTEMATIC NAME: 2-chloranyl-4-fluoranyl-pyridine
MOLECULAR FORMULA: C5H3ClFN
MOLECULAR WEIGHT: 131.535423
SMILES: C1=CN=C(C=C1F)Cl
Structure:
CAS RN: 17282-04-1
CAS Name: 2-chloro-3-fluoropyridine
OPENEYE Name: 2-chloro-3-fluoro-pyridine
IUPAC Name: 2-chloro-3-fluoropyridine
SYSTEMATIC NAME: 2-chloranyl-3-fluoranyl-pyridine
MOLECULAR FORMULA: C5H3ClFN
MOLECULAR WEIGHT: 131.535423
SMILES: C1=CC(=C(N=C1)Cl)F
Structure:
CAS RN: 4793-20-8
CAS Name: 4-chloro-2-fluorobenzoic acid ethyl ester
OPENEYE Name: ethyl 4-chloro-2-fluoro-benzoate
IUPAC Name: ethyl 4-chloro-2-fluorobenzoate
SYSTEMATIC NAME: ethyl 4-chloranyl-2-fluoranyl-benzoate
MOLECULAR FORMULA: C9H8ClFO2
MOLECULAR WEIGHT: 202.610023
SMILES: CCOC(=O)C1=C(C=C(C=C1)Cl)F
Structure:
CAS RN: 870704-14-6
CAS Name: 2-fluoro-5-methylbenzenesulfonyl chloride
OPENEYE Name: 2-fluoro-5-methyl-benzenesulfonyl chloride
IUPAC Name: 2-fluoro-5-methylbenzenesulfonyl chloride
SYSTEMATIC NAME: 2-fluoranyl-5-methyl-benzenesulfonyl chloride
MOLECULAR FORMULA: C7H6ClFO2S
MOLECULAR WEIGHT: 208.637743
SMILES: CC1=CC(=C(C=C1)F)S(=O)(=O)Cl
Structure:
CAS RN: 385-01-3
CAS Name: 3-fluoro-2-nitrophenol
OPENEYE Name: 3-fluoro-2-nitro-phenol
IUPAC Name: 3-fluoro-2-nitrophenol
SYSTEMATIC NAME: 3-fluoranyl-2-nitro-phenol
MOLECULAR FORMULA: C6H4FNO3
MOLECULAR WEIGHT: 157.099263
SMILES: C1=CC(=C(C(=C1)F)[N+](=O)[O-])O
Structure:
CAS RN: 651735-59-0
CAS Name: 7-fluoro-2,3-dihydroinden-1-one
OPENEYE Name: 7-fluoroindan-1-one
IUPAC Name: 7-fluoro-2,3-dihydroinden-1-one
SYSTEMATIC NAME: 7-fluoranyl-2,3-dihydroinden-1-one
MOLECULAR FORMULA: C9H7FO
MOLECULAR WEIGHT: 150.149683
SMILES: C1CC(=O)C2=C1C=CC=C2F
Structure:
CAS RN: 629672-19-1
CAS Name: 4-fluoro-3-methylbenzenesulfonyl chloride
OPENEYE Name: 4-fluoro-3-methyl-benzenesulfonyl chloride
IUPAC Name: 4-fluoro-3-methylbenzenesulfonyl chloride
SYSTEMATIC NAME: 4-fluoranyl-3-methyl-benzenesulfonyl chloride
MOLECULAR FORMULA: C7H6ClFO2S
MOLECULAR WEIGHT: 208.637743
SMILES: CC1=C(C=CC(=C1)S(=O)(=O)Cl)F
Structure:
CAS RN: 444143-45-7
CAS Name: 4-[3,5-bis(trifluoromethyl)phenyl]aniline
OPENEYE Name: 4-[3,5-bis(trifluoromethyl)phenyl]aniline
IUPAC Name: 4-[3,5-bis(trifluoromethyl)phenyl]aniline
SYSTEMATIC NAME: 4-[3,5-bis(trifluoromethyl)phenyl]aniline
MOLECULAR FORMULA: C14H9F6N
MOLECULAR WEIGHT: 305.218379
SMILES: C1=CC(=CC=C1C2=CC(=CC(=C2)C(F)(F)F)C(F)(F)F)N
Structure:
CAS RN: 66684-65-9
CAS Name: 1,2-difluoro-3-methoxy-4-nitrobenzene
OPENEYE Name: 1,2-difluoro-3-methoxy-4-nitro-benzene
IUPAC Name: 1,2-difluoro-3-methoxy-4-nitrobenzene
SYSTEMATIC NAME: 1,2-bis(fluoranyl)-3-methoxy-4-nitro-benzene
MOLECULAR FORMULA: C7H5F2NO3
MOLECULAR WEIGHT: 189.116306
SMILES: COC1=C(C=CC(=C1F)F)[N+](=O)[O-]
Structure:
CAS RN: 128593-93-1
CAS Name: 2,4-dichloro-5-fluorobenzonitrile
OPENEYE Name: 2,4-dichloro-5-fluoro-benzonitrile
IUPAC Name: 2,4-dichloro-5-fluorobenzonitrile
SYSTEMATIC NAME: 2,4-bis(chloranyl)-5-fluoranyl-benzenecarbonitrile
MOLECULAR FORMULA: C7H2Cl2FN
MOLECULAR WEIGHT: 190.001883
SMILES: C1=C(C(=CC(=C1F)Cl)Cl)C#N
Structure:
CAS RN: 116272-41-4
CAS Name: 4-bromo-1-fluoro-2-iodobenzene
OPENEYE Name: 4-bromo-1-fluoro-2-iodo-benzene
IUPAC Name: 4-bromo-1-fluoro-2-iodobenzene
SYSTEMATIC NAME: 4-bromanyl-1-fluoranyl-2-iodanyl-benzene
MOLECULAR FORMULA: C6H3BrFI
MOLECULAR WEIGHT: 300.894893
SMILES: C1=CC(=C(C=C1Br)I)F
Structure:
CAS RN: 189628-38-4
CAS Name: 5-fluoro-2-methoxybenzonitrile
OPENEYE Name: 5-fluoro-2-methoxy-benzonitrile
IUPAC Name: 5-fluoro-2-methoxybenzonitrile
SYSTEMATIC NAME: 5-fluoranyl-2-methoxy-benzenecarbonitrile
MOLECULAR FORMULA: C8H6FNO
MOLECULAR WEIGHT: 151.137743
SMILES: COC1=C(C=C(C=C1)F)C#N
Structure:
CAS RN: 849035-74-1
CAS Name: 1-fluoro-5-methyl-4-methylsulfonyl-2-nitrobenzene
OPENEYE Name: 1-fluoro-5-methyl-4-methylsulfonyl-2-nitro-benzene
IUPAC Name: 1-fluoro-5-methyl-4-methylsulfonyl-2-nitrobenzene
SYSTEMATIC NAME: 1-fluoranyl-5-methyl-4-methylsulfonyl-2-nitro-benzene
MOLECULAR FORMULA: C8H8FNO4S
MOLECULAR WEIGHT: 233.216823
SMILES: CC1=CC(=C(C=C1S(=O)(=O)C)[N+](=O)[O-])F
Structure:
CAS RN: 849021-35-8
CAS Name: 2-(1,3-benzoxazol-2-yl)-1-[4-(trifluoromethyl)phenyl]ethanone
OPENEYE Name: 2-(1,3-benzoxazol-2-yl)-1-[4-(trifluoromethyl)phenyl]ethanone
IUPAC Name: 2-(1,3-benzoxazol-2-yl)-1-[4-(trifluoromethyl)phenyl]ethanone
SYSTEMATIC NAME: 2-(1,3-benzoxazol-2-yl)-1-[4-(trifluoromethyl)phenyl]ethanone
MOLECULAR FORMULA: C16H10F3NO2
MOLECULAR WEIGHT: 305.25131
SMILES: C1=CC=C2C(=C1)N=C(O2)CC(=O)C3=CC=C(C=C3)C(F)(F)F
Structure:
CAS RN: 849021-37-0
CAS Name: 2-(1,3-benzoxazol-2-yl)-1-[3-(trifluoromethyl)phenyl]ethanone
OPENEYE Name: 2-(1,3-benzoxazol-2-yl)-1-[3-(trifluoromethyl)phenyl]ethanone
IUPAC Name: 2-(1,3-benzoxazol-2-yl)-1-[3-(trifluoromethyl)phenyl]ethanone
SYSTEMATIC NAME: 2-(1,3-benzoxazol-2-yl)-1-[3-(trifluoromethyl)phenyl]ethanone
MOLECULAR FORMULA: C16H10F3NO2
MOLECULAR WEIGHT: 305.25131
SMILES: C1=CC=C2C(=C1)N=C(O2)CC(=O)C3=CC(=CC=C3)C(F)(F)F
Structure:
CAS RN: 393183-92-1
CAS Name: 4-(5-fluoro-2,3-dihydroindol-1-yl)-4-oxobutanoic acid
OPENEYE Name: 4-(5-fluoroindolin-1-yl)-4-oxo-butanoic acid
IUPAC Name: 4-(5-fluoro-2,3-dihydroindol-1-yl)-4-oxobutanoic acid
SYSTEMATIC NAME: 4-(5-fluoranyl-2,3-dihydroindol-1-yl)-4-oxidanylidene-butanoic acid
MOLECULAR FORMULA: C12H12FNO3
MOLECULAR WEIGHT: 237.226983
SMILES: C1CN(C2=C1C=C(C=C2)F)C(=O)CCC(=O)O
Structure:
CAS RN: 832714-48-4
CAS Name: (2-fluoro-4-methylsulfonylphenyl)hydrazine
OPENEYE Name: (2-fluoro-4-methylsulfonyl-phenyl)hydrazine
IUPAC Name: (2-fluoro-4-methylsulfonylphenyl)hydrazine
SYSTEMATIC NAME: (2-fluoranyl-4-methylsulfonyl-phenyl)diazane
MOLECULAR FORMULA: C7H9FN2O2S
MOLECULAR WEIGHT: 204.221963
SMILES: CS(=O)(=O)C1=CC(=C(C=C1)NN)F
Structure:
CAS RN: 320-37-6
CAS Name: 4-nitro-2-(trifluoromethyl)benzoic acid
OPENEYE Name: 4-nitro-2-(trifluoromethyl)benzoic acid
IUPAC Name: 4-nitro-2-(trifluoromethyl)benzoic acid
SYSTEMATIC NAME: 4-nitro-2-(trifluoromethyl)benzoic acid
MOLECULAR FORMULA: C8H4F3NO4
MOLECULAR WEIGHT: 235.11687
SMILES: C1=CC(=C(C=C1[N+](=O)[O-])C(F)(F)F)C(=O)O
Structure:
CAS RN: 773873-55-5
CAS Name: 5-fluoro-2-methylsulfonylbenzoic acid
OPENEYE Name: 5-fluoro-2-methylsulfonyl-benzoic acid
IUPAC Name: 5-fluoro-2-methylsulfonylbenzoic acid
SYSTEMATIC NAME: 5-fluoranyl-2-methylsulfonyl-benzoic acid
MOLECULAR FORMULA: C8H7FO4S
MOLECULAR WEIGHT: 218.202183
SMILES: CS(=O)(=O)C1=C(C=C(C=C1)F)C(=O)O
Structure:
CAS RN: 402-19-7
CAS Name: 2-methylsulfonyl-5-(trifluoromethyl)aniline
OPENEYE Name: 2-methylsulfonyl-5-(trifluoromethyl)aniline
IUPAC Name: 2-methylsulfonyl-5-(trifluoromethyl)aniline
SYSTEMATIC NAME: 2-methylsulfonyl-5-(trifluoromethyl)aniline
MOLECULAR FORMULA: C8H8F3NO2S
MOLECULAR WEIGHT: 239.21483
SMILES: CS(=O)(=O)C1=C(C=C(C=C1)C(F)(F)F)N
Structure:
CAS RN: 849938-78-9
CAS Name: 1-(4-fluoro-2-methylsulfonylphenyl)piperazine
OPENEYE Name: 1-(4-fluoro-2-methylsulfonyl-phenyl)piperazine
IUPAC Name: 1-(4-fluoro-2-methylsulfonylphenyl)piperazine
SYSTEMATIC NAME: 1-(4-fluoranyl-2-methylsulfonyl-phenyl)piperazine
MOLECULAR FORMULA: C11H15FN2O2S
MOLECULAR WEIGHT: 258.312403
SMILES: CS(=O)(=O)C1=C(C=CC(=C1)F)N2CCNCC2
Structure:
CAS RN: 849035-87-6
CAS Name: 5-fluoro-7-methylsulfonyl-1H-indole-2-carboxylic acid
OPENEYE Name: 5-fluoro-7-methylsulfonyl-1H-indole-2-carboxylic acid
IUPAC Name: 5-fluoro-7-methylsulfonyl-1H-indole-2-carboxylic acid
SYSTEMATIC NAME: 5-fluoranyl-7-methylsulfonyl-1H-indole-2-carboxylic acid
MOLECULAR FORMULA: C10H8FNO4S
MOLECULAR WEIGHT: 257.238223
SMILES: CS(=O)(=O)C1=C2C(=CC(=C1)F)C=C(N2)C(=O)O
Structure:
CAS RN: 849035-71-8
CAS Name: 5-fluoro-2-methylsulfonylbenzaldehyde
OPENEYE Name: 5-fluoro-2-methylsulfonyl-benzaldehyde
IUPAC Name: 5-fluoro-2-methylsulfonylbenzaldehyde
SYSTEMATIC NAME: 5-fluoranyl-2-methylsulfonyl-benzaldehyde
MOLECULAR FORMULA: C8H7FO3S
MOLECULAR WEIGHT: 202.202783
SMILES: CS(=O)(=O)C1=C(C=C(C=C1)F)C=O
Structure:
CAS RN: 55377-78-1
CAS Name: 5-[4-(trifluoromethyl)phenyl]-2-furancarboxylic acid
OPENEYE Name: 5-[4-(trifluoromethyl)phenyl]furan-2-carboxylic acid
IUPAC Name: 5-[4-(trifluoromethyl)phenyl]furan-2-carboxylic acid
SYSTEMATIC NAME: 5-[4-(trifluoromethyl)phenyl]furan-2-carboxylic acid
MOLECULAR FORMULA: C12H7F3O3
MOLECULAR WEIGHT: 256.17739
SMILES: C1=CC(=CC=C1C2=CC=C(O2)C(=O)O)C(F)(F)F
Structure:
CAS RN: 195457-70-6
CAS Name: 4-[3-(trifluoromethyl)phenyl]benzoic acid
OPENEYE Name: 4-[3-(trifluoromethyl)phenyl]benzoic acid
IUPAC Name: 4-[3-(trifluoromethyl)phenyl]benzoic acid
SYSTEMATIC NAME: 4-[3-(trifluoromethyl)phenyl]benzoic acid
MOLECULAR FORMULA: C14H9F3O2
MOLECULAR WEIGHT: 266.21527
SMILES: C1=CC(=CC(=C1)C(F)(F)F)C2=CC=C(C=C2)C(=O)O
Structure:
CAS RN: 168619-05-4
CAS Name: 3-[3-(trifluoromethyl)phenyl]benzoic acid
OPENEYE Name: 3-[3-(trifluoromethyl)phenyl]benzoic acid
IUPAC Name: 3-[3-(trifluoromethyl)phenyl]benzoic acid
SYSTEMATIC NAME: 3-[3-(trifluoromethyl)phenyl]benzoic acid
MOLECULAR FORMULA: C14H9F3O2
MOLECULAR WEIGHT: 266.21527
SMILES: C1=CC(=CC(=C1)C(=O)O)C2=CC(=CC=C2)C(F)(F)F
Structure:
CAS RN: 198205-79-7
CAS Name: 4-[2-(trifluoromethyl)phenyl]benzoic acid
OPENEYE Name: 4-[2-(trifluoromethyl)phenyl]benzoic acid
IUPAC Name: 4-[2-(trifluoromethyl)phenyl]benzoic acid
SYSTEMATIC NAME: 4-[2-(trifluoromethyl)phenyl]benzoic acid
MOLECULAR FORMULA: C14H9F3O2
MOLECULAR WEIGHT: 266.21527
SMILES: C1=CC=C(C(=C1)C2=CC=C(C=C2)C(=O)O)C(F)(F)F
Structure:
CAS RN: 168618-48-2
CAS Name: 3-[2-(trifluoromethyl)phenyl]benzoic acid
OPENEYE Name: 3-[2-(trifluoromethyl)phenyl]benzoic acid
IUPAC Name: 3-[2-(trifluoromethyl)phenyl]benzoic acid
SYSTEMATIC NAME: 3-[2-(trifluoromethyl)phenyl]benzoic acid
MOLECULAR FORMULA: C14H9F3O2
MOLECULAR WEIGHT: 266.21527
SMILES: C1=CC=C(C(=C1)C2=CC(=CC=C2)C(=O)O)C(F)(F)F
Structure:
CAS RN: 90035-34-0
CAS Name: 4-[4-(trifluoromethyl)phenyl]benzaldehyde
OPENEYE Name: 4-[4-(trifluoromethyl)phenyl]benzaldehyde
IUPAC Name: 4-[4-(trifluoromethyl)phenyl]benzaldehyde
SYSTEMATIC NAME: 4-[4-(trifluoromethyl)phenyl]benzaldehyde
MOLECULAR FORMULA: C14H9F3O
MOLECULAR WEIGHT: 250.21587
SMILES: C1=CC(=CC=C1C=O)C2=CC=C(C=C2)C(F)(F)F
Structure:
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