CAS RN: 421-11-4
CAS Name: iodo(trifluoromethyl)mercury
OPENEYE Name: iodo(trifluoromethyl)mercury
IUPAC Name: iodo(trifluoromethyl)mercury
SYSTEMATIC NAME: iodanyl(trifluoromethyl)mercury
MOLECULAR FORMULA: CF3HgI
MOLECULAR WEIGHT: 396.50038
SMILES: C(F)(F)(F)[Hg]I
Structure:
CAS RN: 420-52-0
CAS Name: trifluoromethylphosphine
OPENEYE Name: trifluoromethylphosphane
IUPAC Name: trifluoromethylphosphane
SYSTEMATIC NAME: trifluoromethylphosphane
MOLECULAR FORMULA: CH2F3P
MOLECULAR WEIGHT: 101.995551
SMILES: C(F)(F)(F)P
Structure:
CAS RN: 420-47-3
CAS Name: 1-bromo-1,1-difluoroethane
OPENEYE Name: 1-bromo-1,1-difluoro-ethane
IUPAC Name: 1-bromo-1,1-difluoroethane
SYSTEMATIC NAME: 1-bromanyl-1,1-bis(fluoranyl)ethane
MOLECULAR FORMULA: C2H3BrF2
MOLECULAR WEIGHT: 144.946026
SMILES: CC(F)(F)Br
Structure:
CAS RN: 420-42-8
CAS Name: trifluoromethylarsine
OPENEYE Name: trifluoromethylarsane
IUPAC Name: trifluoromethylarsane
SYSTEMATIC NAME: trifluoromethylarsane
MOLECULAR FORMULA: CH2AsF3
MOLECULAR WEIGHT: 145.94339
SMILES: C(F)(F)(F)[AsH2]
Structure:
CAS RN: 407-70-5
CAS Name: 1,1,4,4-tetrafluorobuta-1,3-diene
OPENEYE Name: 1,1,4,4-tetrafluorobuta-1,3-diene
IUPAC Name: 1,1,4,4-tetrafluorobuta-1,3-diene
SYSTEMATIC NAME: 1,1,4,4-tetrakis(fluoranyl)buta-1,3-diene
MOLECULAR FORMULA: C4H2F4
MOLECULAR WEIGHT: 126.052293
SMILES: C(=C(F)F)C=C(F)F
Structure:
CAS RN: 406-95-1
CAS Name: acetic acid 2,2,2-trifluoroethyl ester
OPENEYE Name: 2,2,2-trifluoroethyl acetate
IUPAC Name: 2,2,2-trifluoroethyl acetate
SYSTEMATIC NAME: 2,2,2-tris(fluoranyl)ethyl ethanoate
MOLECULAR FORMULA: C4H5F3O2
MOLECULAR WEIGHT: 142.07651
SMILES: CC(=O)OCC(F)(F)F
Structure:
CAS RN: 406-49-5
CAS Name: 1,1,1-trifluoro-3-methylbutane
OPENEYE Name: 1,1,1-trifluoro-3-methyl-butane
IUPAC Name: 1,1,1-trifluoro-3-methylbutane
SYSTEMATIC NAME: 1,1,1-tris(fluoranyl)-3-methyl-butane
MOLECULAR FORMULA: C5H9F3
MOLECULAR WEIGHT: 126.12017
SMILES: CC(C)CC(F)(F)F
Structure:
CAS RN: 405-97-0
CAS Name: 2-fluoroethoxybenzene
OPENEYE Name: 2-fluoroethoxybenzene
IUPAC Name: 2-fluoroethoxybenzene
SYSTEMATIC NAME: 2-fluoranylethoxybenzene
MOLECULAR FORMULA: C8H9FO
MOLECULAR WEIGHT: 140.154863
SMILES: C1=CC=C(C=C1)OCCF
Structure:
CAS RN: 405-51-6
CAS Name: acetic acid (4-fluorophenyl) ester
OPENEYE Name: (4-fluorophenyl) acetate
IUPAC Name: (4-fluorophenyl) acetate
SYSTEMATIC NAME: (4-fluorophenyl) ethanoate
MOLECULAR FORMULA: C8H7FO2
MOLECULAR WEIGHT: 154.138383
SMILES: CC(=O)OC1=CC=C(C=C1)F
Structure:
CAS RN: 405-31-2
CAS Name: 1-fluoro-4-[(4-fluorophenyl)disulfanyl]benzene
OPENEYE Name: 1-fluoro-4-[(4-fluorophenyl)disulfanyl]benzene
IUPAC Name: 1-fluoro-4-[(4-fluorophenyl)disulfanyl]benzene
SYSTEMATIC NAME: 1-fluoranyl-4-[(4-fluorophenyl)disulfanyl]benzene
MOLECULAR FORMULA: C12H8F2S2
MOLECULAR WEIGHT: 254.318726
SMILES: C1=CC(=CC=C1F)SSC2=CC=C(C=C2)F
Structure:
CAS RN: 404-90-0
CAS Name: 2-(3-fluoro-4-methoxyphenyl)acetonitrile
OPENEYE Name: 2-(3-fluoro-4-methoxy-phenyl)acetonitrile
IUPAC Name: 2-(3-fluoro-4-methoxyphenyl)acetonitrile
SYSTEMATIC NAME: 2-(3-fluoranyl-4-methoxy-phenyl)ethanenitrile
MOLECULAR FORMULA: C9H8FNO
MOLECULAR WEIGHT: 165.164323
SMILES: COC1=C(C=C(C=C1)CC#N)F
Structure:
CAS RN: 403-96-3
CAS Name: 1,3-bis[3-(trifluoromethyl)phenyl]urea
OPENEYE Name: 1,3-bis[3-(trifluoromethyl)phenyl]urea
IUPAC Name: 1,3-bis[3-(trifluoromethyl)phenyl]urea
SYSTEMATIC NAME: 1,3-bis[3-(trifluoromethyl)phenyl]urea
MOLECULAR FORMULA: C15H10F6N2O
MOLECULAR WEIGHT: 348.243119
SMILES: C1=CC(=CC(=C1)NC(=O)NC2=CC=CC(=C2)C(F)(F)F)C(F)(F)F
Structure:
CAS RN: 403-46-3
CAS Name: 4-fluoro-N,N-dimethylaniline
OPENEYE Name: 4-fluoro-N,N-dimethyl-aniline
IUPAC Name: 4-fluoro-N,N-dimethylaniline
SYSTEMATIC NAME: 4-fluoranyl-N,N-dimethyl-aniline
MOLECULAR FORMULA: C8H10FN
MOLECULAR WEIGHT: 139.170103
SMILES: CN(C)C1=CC=C(C=C1)F
Structure:
CAS RN: 401-95-6
CAS Name: 3,5-bis(trifluoromethyl)benzaldehyde
OPENEYE Name: 3,5-bis(trifluoromethyl)benzaldehyde
IUPAC Name: 3,5-bis(trifluoromethyl)benzaldehyde
SYSTEMATIC NAME: 3,5-bis(trifluoromethyl)benzaldehyde
MOLECULAR FORMULA: C9H4F6O
MOLECULAR WEIGHT: 242.117879
SMILES: C1=C(C=C(C=C1C(F)(F)F)C(F)(F)F)C=O
Structure:
CAS RN: 401-79-6
CAS Name: 1-methyl-3-(trifluoromethyl)benzene
OPENEYE Name: 1-methyl-3-(trifluoromethyl)benzene
IUPAC Name: 1-methyl-3-(trifluoromethyl)benzene
SYSTEMATIC NAME: 1-methyl-3-(trifluoromethyl)benzene
MOLECULAR FORMULA: C8H7F3
MOLECULAR WEIGHT: 160.13639
SMILES: CC1=CC(=CC=C1)C(F)(F)F
Structure:
CAS RN: 400-58-8
CAS Name: 2-[[1-oxo-2-[(2,2,2-trifluoro-1-oxoethyl)amino]ethyl]amino]acetic acid
OPENEYE Name: 2-[[2-[(2,2,2-trifluoroacetyl)amino]acetyl]amino]acetic acid
IUPAC Name: 2-[[2-[(2,2,2-trifluoroacetyl)amino]acetyl]amino]acetic acid
SYSTEMATIC NAME: 2-[2-[2,2,2-tris(fluoranyl)ethanoylamino]ethanoylamino]ethanoic acid
MOLECULAR FORMULA: C6H7F3N2O4
MOLECULAR WEIGHT: 228.12599
SMILES: C(C(=O)NCC(=O)O)NC(=O)C(F)(F)F
Structure:
CAS RN: 400-52-2
CAS Name: 2,2,2-trifluoroacetic acid tert-butyl ester
OPENEYE Name: tert-butyl 2,2,2-trifluoroacetate
IUPAC Name: tert-butyl 2,2,2-trifluoroacetate
SYSTEMATIC NAME: tert-butyl 2,2,2-tris(fluoranyl)ethanoate
MOLECULAR FORMULA: C6H9F3O2
MOLECULAR WEIGHT: 170.12967
SMILES: CC(C)(C)OC(=O)C(F)(F)F
Structure:
CAS RN: 400-13-5
CAS Name: 2-fluorothiophene
OPENEYE Name: 2-fluorothiophene
IUPAC Name: 2-fluorothiophene
SYSTEMATIC NAME: 2-fluoranylthiophene
MOLECULAR FORMULA: C4H3FS
MOLECULAR WEIGHT: 102.130023
SMILES: C1=CSC(=C1)F
Structure:
CAS RN: 400-05-5
CAS Name: 1,4-dichloro-2,5-difluorobenzene
OPENEYE Name: 1,4-dichloro-2,5-difluoro-benzene
IUPAC Name: 1,4-dichloro-2,5-difluorobenzene
SYSTEMATIC NAME: 1,4-bis(chloranyl)-2,5-bis(fluoranyl)benzene
MOLECULAR FORMULA: C6H2Cl2F2
MOLECULAR WEIGHT: 182.982886
SMILES: C1=C(C(=CC(=C1Cl)F)Cl)F
Structure:
CAS RN: 399-66-6
CAS Name: [1,2,4]triazolo[1,5-a]pyrazine
OPENEYE Name: [1,2,4]triazolo[1,5-a]pyrazine
IUPAC Name: [1,2,4]triazolo[1,5-a]pyrazine
SYSTEMATIC NAME: [1,2,4]triazolo[1,5-a]pyrazine
MOLECULAR FORMULA: C5H4N4
MOLECULAR WEIGHT: 120.11206
SMILES: C1=CN2C(=NC=N2)C=N1
Structure:
CAS RN: 399-55-3
CAS Name: 2-fluoro-1-methoxy-4-methylbenzene
OPENEYE Name: 2-fluoro-1-methoxy-4-methyl-benzene
IUPAC Name: 2-fluoro-1-methoxy-4-methylbenzene
SYSTEMATIC NAME: 2-fluoranyl-1-methoxy-4-methyl-benzene
MOLECULAR FORMULA: C8H9FO
MOLECULAR WEIGHT: 140.154863
SMILES: CC1=CC(=C(C=C1)OC)F
Structure:
CAS RN: 399-54-2
CAS Name: 4-fluoro-1-methoxy-2-methylbenzene
OPENEYE Name: 4-fluoro-1-methoxy-2-methyl-benzene
IUPAC Name: 4-fluoro-1-methoxy-2-methylbenzene
SYSTEMATIC NAME: 4-fluoranyl-1-methoxy-2-methyl-benzene
MOLECULAR FORMULA: C8H9FO
MOLECULAR WEIGHT: 140.154863
SMILES: CC1=C(C=CC(=C1)F)OC
Structure:
CAS RN: 398-14-1
CAS Name: acridophosphine
OPENEYE Name: acridophosphine
IUPAC Name: acridophosphine
SYSTEMATIC NAME: acridophosphine
MOLECULAR FORMULA: C13H9P
MOLECULAR WEIGHT: 196.184321
SMILES: C1=CC=C2C(=C1)C=C3C=CC=CC3=P2
Structure:
CAS RN: 394-59-2
CAS Name: 2,2,2-trifluoro-1-(4-methylphenyl)ethanone
OPENEYE Name: 2,2,2-trifluoro-1-(p-tolyl)ethanone
IUPAC Name: 2,2,2-trifluoro-1-(4-methylphenyl)ethanone
SYSTEMATIC NAME: 2,2,2-tris(fluoranyl)-1-(4-methylphenyl)ethanone
MOLECULAR FORMULA: C9H7F3O
MOLECULAR WEIGHT: 188.14649
SMILES: CC1=CC=C(C=C1)C(=O)C(F)(F)F
Structure:
CAS RN: 394-33-2
CAS Name: 4-fluoro-2-nitrophenol
OPENEYE Name: 4-fluoro-2-nitro-phenol
IUPAC Name: 4-fluoro-2-nitrophenol
SYSTEMATIC NAME: 4-fluoranyl-2-nitro-phenol
MOLECULAR FORMULA: C6H4FNO3
MOLECULAR WEIGHT: 157.099263
SMILES: C1=CC(=C(C=C1F)[N+](=O)[O-])O
Structure:
CAS RN: 393-02-2
CAS Name: 1,2,3,4-tetrakis(trifluoromethyl)tetraphosphetane
OPENEYE Name: 1,2,3,4-tetrakis(trifluoromethyl)tetraphosphetane
IUPAC Name: 1,2,3,4-tetrakis(trifluoromethyl)tetraphosphetane
SYSTEMATIC NAME: 1,2,3,4-tetrakis(trifluoromethyl)-1,2,3,4-tetraphosphetane
MOLECULAR FORMULA: C4F12P4
MOLECULAR WEIGHT: 399.918682
SMILES: C(F)(F)(F)P1P(P(P1C(F)(F)F)C(F)(F)F)C(F)(F)F
Structure:
CAS RN: 392-69-8
CAS Name: 2-fluoro-1,3,5-trimethylbenzene
OPENEYE Name: 2-fluoro-1,3,5-trimethyl-benzene
IUPAC Name: 2-fluoro-1,3,5-trimethylbenzene
SYSTEMATIC NAME: 2-fluoranyl-1,3,5-trimethyl-benzene
MOLECULAR FORMULA: C9H11F
MOLECULAR WEIGHT: 138.182043
SMILES: CC1=CC(=C(C(=C1)C)F)C
Structure:
CAS RN: 392-63-2
CAS Name: N,N-diethyl-2,2,3,3-tetrafluoropropanamide
OPENEYE Name: N,N-diethyl-2,2,3,3-tetrafluoro-propanamide
IUPAC Name: N,N-diethyl-2,2,3,3-tetrafluoropropanamide
SYSTEMATIC NAME: N,N-diethyl-2,2,3,3-tetrakis(fluoranyl)propanamide
MOLECULAR FORMULA: C7H11F4NO
MOLECULAR WEIGHT: 201.161953
SMILES: CCN(CC)C(=O)C(C(F)F)(F)F
Structure:
CAS RN: 389-58-2
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C9H6S2
MOLECULAR WEIGHT: 178.27394
SMILES: C1C2=C(C3=C1C=CS3)SC=C2
Structure:
CAS RN: 385-16-0
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C34H20
MOLECULAR WEIGHT: 428.5226
SMILES: C1=CC=C2C=C3C=C4C(=CC3=CC2=C1)C5=CC=CC=C5C6=C4C7=CC=CC=C7C8=CC=CC=C86
Structure:
CAS RN: 385-15-9
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C34H20
MOLECULAR WEIGHT: 428.5226
SMILES: C1=CC=C2C=C3C(=CC2=C1)C4=CC=CC=C4C5=C3C6=CC=CC=C6C7=CC8=CC=CC=C8C=C75
Structure:
CAS RN: 383-90-4
CAS Name: N-[dimethylamino(fluoro)boranyl]-N-methylmethanamine
OPENEYE Name: N-[dimethylamino(fluoro)boranyl]-N-methyl-methanamine
IUPAC Name: N-[dimethylamino(fluoro)boranyl]-N-methylmethanamine
SYSTEMATIC NAME: N-[dimethylamino(fluoranyl)boranyl]-N-methyl-methanamine
MOLECULAR FORMULA: C4H12BFN2
MOLECULAR WEIGHT: 117.960883
SMILES: B(N(C)C)(N(C)C)F
Structure:
CAS RN: 383-72-2
CAS Name: 2-[(2,2,2-trifluoro-1-oxoethyl)amino]acetic acid methyl ester
OPENEYE Name: methyl 2-[(2,2,2-trifluoroacetyl)amino]acetate
IUPAC Name: methyl 2-[(2,2,2-trifluoroacetyl)amino]acetate
SYSTEMATIC NAME: methyl 2-[2,2,2-tris(fluoranyl)ethanoylamino]ethanoate
MOLECULAR FORMULA: C5H6F3NO3
MOLECULAR WEIGHT: 185.10125
SMILES: COC(=O)CNC(=O)C(F)(F)F
Structure:
CAS RN: 383-70-0
CAS Name: 2-[(2,2,2-trifluoro-1-oxoethyl)amino]acetic acid
OPENEYE Name: 2-[(2,2,2-trifluoroacetyl)amino]acetic acid
IUPAC Name: 2-[(2,2,2-trifluoroacetyl)amino]acetic acid
SYSTEMATIC NAME: 2-[2,2,2-tris(fluoranyl)ethanoylamino]ethanoic acid
MOLECULAR FORMULA: C4H4F3NO3
MOLECULAR WEIGHT: 171.07467
SMILES: C(C(=O)O)NC(=O)C(F)(F)F
Structure:
CAS RN: 382-24-1
CAS Name: 1,1,1,3,3,3-hexafluoro-2-(trifluoromethyl)propane
OPENEYE Name: 1,1,1,3,3,3-hexafluoro-2-(trifluoromethyl)propane
IUPAC Name: 1,1,1,3,3,3-hexafluoro-2-(trifluoromethyl)propane
SYSTEMATIC NAME: 1,1,1,3,3,3-hexakis(fluoranyl)-2-(trifluoromethyl)propane
MOLECULAR FORMULA: C4HF9
MOLECULAR WEIGHT: 220.036369
SMILES: C(C(F)(F)F)(C(F)(F)F)C(F)(F)F
Structure:
CAS RN: 381-83-9
CAS Name: 2-(chloromethyl)-3,3,3-trifluoro-1-propene
OPENEYE Name: 2-(chloromethyl)-3,3,3-trifluoro-prop-1-ene
IUPAC Name: 2-(chloromethyl)-3,3,3-trifluoroprop-1-ene
SYSTEMATIC NAME: 2-(chloromethyl)-3,3,3-tris(fluoranyl)prop-1-ene
MOLECULAR FORMULA: C4H4ClF3
MOLECULAR WEIGHT: 144.52277
SMILES: C=C(CCl)C(F)(F)F
Structure:
CAS RN: 381-60-2
CAS Name: difluoro-(methylthio)borane
OPENEYE Name: difluoro(methylsulfanyl)borane
IUPAC Name: difluoro(methylsulfanyl)borane
SYSTEMATIC NAME: bis(fluoranyl)-methylsulfanyl-borane
MOLECULAR FORMULA: CH3BF2S
MOLECULAR WEIGHT: 95.907326
SMILES: B(F)(F)SC
Structure:
CAS RN: 381-59-9
CAS Name: difluoro(methoxy)borane
OPENEYE Name: difluoro(methoxy)borane
IUPAC Name: difluoro(methoxy)borane
SYSTEMATIC NAME: bis(fluoranyl)-methoxy-borane
MOLECULAR FORMULA: CH3BF2O
MOLECULAR WEIGHT: 79.841726
SMILES: B(OC)(F)F
Structure:
CAS RN: 380-78-9
CAS Name: 2-bromo-1-ethoxy-1,1,2-trifluoroethane
OPENEYE Name: 2-bromo-1-ethoxy-1,1,2-trifluoro-ethane
IUPAC Name: 2-bromo-1-ethoxy-1,1,2-trifluoroethane
SYSTEMATIC NAME: 2-bromanyl-1-ethoxy-1,1,2-tris(fluoranyl)ethane
MOLECULAR FORMULA: C4H6BrF3O
MOLECULAR WEIGHT: 206.98905
SMILES: CCOC(C(F)Br)(F)F
Structure:
CAS RN: 378-13-2
CAS Name: 1,4-dibromo-2-chloro-1,1,2-trifluorobutane
OPENEYE Name: 1,4-dibromo-2-chloro-1,1,2-trifluoro-butane
IUPAC Name: 1,4-dibromo-2-chloro-1,1,2-trifluorobutane
SYSTEMATIC NAME: 1,4-bis(bromanyl)-2-chloranyl-1,1,2-tris(fluoranyl)butane
MOLECULAR FORMULA: C4H4Br2ClF3
MOLECULAR WEIGHT: 304.33077
SMILES: C(CBr)C(C(F)(F)Br)(F)Cl
Structure:
CAS RN: 377-93-5
CAS Name: 1,2-dichloro-3,3,4,4-tetrafluorocyclobutene
OPENEYE Name: 1,2-dichloro-3,3,4,4-tetrafluoro-cyclobutene
IUPAC Name: 1,2-dichloro-3,3,4,4-tetrafluorocyclobutene
SYSTEMATIC NAME: 1,2-bis(chloranyl)-3,3,4,4-tetrakis(fluoranyl)cyclobutene
MOLECULAR FORMULA: C4Cl2F4
MOLECULAR WEIGHT: 194.942413
SMILES: C1(=C(C(C1(F)F)(F)F)Cl)Cl
Structure:
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