CAS RN: 71050-40-3
CAS Name: 4-methoxy-3-thiophenecarboxylic acid
OPENEYE Name: 4-methoxythiophene-3-carboxylic acid
IUPAC Name: 4-methoxythiophene-3-carboxylic acid
SYSTEMATIC NAME: 4-methoxythiophene-3-carboxylic acid
MOLECULAR FORMULA: C6H6O3S
MOLECULAR WEIGHT: 158.17504
SMILES: COC1=CSC=C1C(=O)O
Structure:
CAS RN: 18527-19-0
CAS Name: 2-[(4-chlorophenyl)thio]acetonitrile
OPENEYE Name: 2-(4-chlorophenyl)sulfanylacetonitrile
IUPAC Name: 2-(4-chlorophenyl)sulfanylacetonitrile
SYSTEMATIC NAME: 2-(4-chlorophenyl)sulfanylethanenitrile
MOLECULAR FORMULA: C8H6ClNS
MOLECULAR WEIGHT: 183.65794
SMILES: C1=CC(=CC=C1SCC#N)Cl
Structure:
CAS RN: 92814-00-1
CAS Name: 1-(bromomethyl)-2,3,5,6-tetrafluoro-4-methylbenzene
OPENEYE Name: 1-(bromomethyl)-2,3,5,6-tetrafluoro-4-methyl-benzene
IUPAC Name: 1-(bromomethyl)-2,3,5,6-tetrafluoro-4-methylbenzene
SYSTEMATIC NAME: 1-(bromomethyl)-2,3,5,6-tetrakis(fluoranyl)-4-methyl-benzene
MOLECULAR FORMULA: C8H5BrF4
MOLECULAR WEIGHT: 257.022913
SMILES: CC1=C(C(=C(C(=C1F)F)CBr)F)F
Structure:
CAS RN: 382-34-3
CAS Name: 1,1,1,2,3,3-hexafluoro-3-methoxypropane
OPENEYE Name: 1,1,1,2,3,3-hexafluoro-3-methoxy-propane
IUPAC Name: 1,1,1,2,3,3-hexafluoro-3-methoxypropane
SYSTEMATIC NAME: 1,1,1,2,3,3-hexakis(fluoranyl)-3-methoxy-propane
MOLECULAR FORMULA: C4H4F6O
MOLECULAR WEIGHT: 182.064379
SMILES: COC(C(C(F)(F)F)F)(F)F
Structure:
CAS RN: 74359-06-1
CAS Name: 2-fluoro-2-propenoic acid 1,1,1,3,3,3-hexafluoropropan-2-yl ester
OPENEYE Name: [2,2,2-trifluoro-1-(trifluoromethyl)ethyl] 2-fluoroprop-2-enoate
IUPAC Name: 1,1,1,3,3,3-hexafluoropropan-2-yl 2-fluoroprop-2-enoate
SYSTEMATIC NAME: 1,1,1,3,3,3-hexakis(fluoranyl)propan-2-yl 2-fluoranylprop-2-enoate
MOLECULAR FORMULA: C6H3F7O2
MOLECULAR WEIGHT: 240.075642
SMILES: C=C(C(=O)OC(C(F)(F)F)C(F)(F)F)F
Structure:
CAS RN: 179756-91-3
CAS Name: 2-(1-piperazinyl)-4-(trifluoromethyl)pyrimidine
OPENEYE Name: 2-piperazin-1-yl-4-(trifluoromethyl)pyrimidine
IUPAC Name: 2-piperazin-1-yl-4-(trifluoromethyl)pyrimidine
SYSTEMATIC NAME: 2-piperazin-1-yl-4-(trifluoromethyl)pyrimidine
MOLECULAR FORMULA: C9H11F3N4
MOLECULAR WEIGHT: 232.20565
SMILES: C1CN(CCN1)C2=NC=CC(=N2)C(F)(F)F
Structure:
CAS RN: 117358-51-7
CAS Name: 1,3-difluoro-5-methylbenzene
OPENEYE Name: 1,3-difluoro-5-methyl-benzene
IUPAC Name: 1,3-difluoro-5-methylbenzene
SYSTEMATIC NAME: 1,3-bis(fluoranyl)-5-methyl-benzene
MOLECULAR FORMULA: C7H6F2
MOLECULAR WEIGHT: 128.119346
SMILES: CC1=CC(=CC(=C1)F)F
Structure:
CAS RN: 351003-48-0
CAS Name: 3-chloro-2-fluorobenzenesulfonyl chloride
OPENEYE Name: 3-chloro-2-fluoro-benzenesulfonyl chloride
IUPAC Name: 3-chloro-2-fluorobenzenesulfonyl chloride
SYSTEMATIC NAME: 3-chloranyl-2-fluoranyl-benzenesulfonyl chloride
MOLECULAR FORMULA: C6H3Cl2FO2S
MOLECULAR WEIGHT: 229.056223
SMILES: C1=CC(=C(C(=C1)Cl)F)S(=O)(=O)Cl
Structure:
CAS RN: 106447-97-6
CAS Name: 4-(trifluoromethyl)-2-pyridinamine
OPENEYE Name: 4-(trifluoromethyl)pyridin-2-amine
IUPAC Name: 4-(trifluoromethyl)pyridin-2-amine
SYSTEMATIC NAME: 4-(trifluoromethyl)pyridin-2-amine
MOLECULAR FORMULA: C6H5F3N2
MOLECULAR WEIGHT: 162.11251
SMILES: C1=CN=C(C=C1C(F)(F)F)N
Structure:
CAS RN: 20857-47-0
CAS Name: 3,5-bis(trifluoromethyl)pyridine
OPENEYE Name: 3,5-bis(trifluoromethyl)pyridine
IUPAC Name: 3,5-bis(trifluoromethyl)pyridine
SYSTEMATIC NAME: 3,5-bis(trifluoromethyl)pyridine
MOLECULAR FORMULA: C7H3F6N
MOLECULAR WEIGHT: 215.095839
SMILES: C1=C(C=NC=C1C(F)(F)F)C(F)(F)F
Structure:
CAS RN: 277756-46-4
CAS Name: 1-(trifluoromethyl)-1-cyclopropanecarboxylic acid
OPENEYE Name: 1-(trifluoromethyl)cyclopropanecarboxylic acid
IUPAC Name: 1-(trifluoromethyl)cyclopropane-1-carboxylic acid
SYSTEMATIC NAME: 1-(trifluoromethyl)cyclopropane-1-carboxylic acid
MOLECULAR FORMULA: C5H5F3O2
MOLECULAR WEIGHT: 154.08721
SMILES: C1CC1(C(=O)O)C(F)(F)F
Structure:
CAS RN: 503179-70-2
CAS Name: 3-(trifluoromethoxy)benzenesulfonamide
OPENEYE Name: 3-(trifluoromethoxy)benzenesulfonamide
IUPAC Name: 3-(trifluoromethoxy)benzenesulfonamide
SYSTEMATIC NAME: 3-(trifluoromethyloxy)benzenesulfonamide
MOLECULAR FORMULA: C7H6F3NO3S
MOLECULAR WEIGHT: 241.18765
SMILES: C1=CC(=CC(=C1)S(=O)(=O)N)OC(F)(F)F
Structure:
CAS RN: 396716-52-2
CAS Name: 1,2-dibromo-1,2,3,3,3-pentafluoro-1-(2,2,2-trifluoroethoxy)propane
OPENEYE Name: 1,2-dibromo-1,2,3,3,3-pentafluoro-1-(2,2,2-trifluoroethoxy)propane
IUPAC Name: 1,2-dibromo-1,2,3,3,3-pentafluoro-1-(2,2,2-trifluoroethoxy)propane
SYSTEMATIC NAME: 1,2-bis(bromanyl)-1,2,3,3,3-pentakis(fluoranyl)-1-[2,2,2-tris(fluoranyl)ethoxy]propane
MOLECULAR FORMULA: C5H2Br2F8O
MOLECULAR WEIGHT: 389.864006
SMILES: C(C(F)(F)F)OC(C(C(F)(F)F)(F)Br)(F)Br
Structure:
CAS RN: 56860-83-4
CAS Name: 1,1,1,2,3,3-hexafluoro-3-(trichloromethoxy)propane
OPENEYE Name: 1,1,1,2,3,3-hexafluoro-3-(trichloromethoxy)propane
IUPAC Name: 1,1,1,2,3,3-hexafluoro-3-(trichloromethoxy)propane
SYSTEMATIC NAME: 1,1,1,2,3,3-hexakis(fluoranyl)-3-(trichloromethyloxy)propane
MOLECULAR FORMULA: C4HCl3F6O
MOLECULAR WEIGHT: 285.399559
SMILES: C(C(OC(Cl)(Cl)Cl)(F)F)(C(F)(F)F)F
Structure:
CAS RN: 106312-36-1
CAS Name: 4-methoxy-2-(trifluoromethyl)benzaldehyde
OPENEYE Name: 4-methoxy-2-(trifluoromethyl)benzaldehyde
IUPAC Name: 4-methoxy-2-(trifluoromethyl)benzaldehyde
SYSTEMATIC NAME: 4-methoxy-2-(trifluoromethyl)benzaldehyde
MOLECULAR FORMULA: C9H7F3O2
MOLECULAR WEIGHT: 204.14589
SMILES: COC1=CC(=C(C=C1)C=O)C(F)(F)F
Structure:
CAS RN: 5068-14-4
CAS Name: tris(4-chlorophenyl)-methylphosphonium iodide
OPENEYE Name: tris(4-chlorophenyl)-methyl-phosphonium iodide
IUPAC Name: tris(4-chlorophenyl)-methylphosphanium iodide
SYSTEMATIC NAME: tris(4-chlorophenyl)-methyl-phosphanium iodide
MOLECULAR FORMULA: C19H15Cl3IP
MOLECULAR WEIGHT: 507.559631
SMILES: C[P+](C1=CC=C(C=C1)Cl)(C2=CC=C(C=C2)Cl)C3=CC=C(C=C3)Cl.[I-]
Structure:
CAS RN: 61272-76-2
CAS Name: 4-fluoro-2-iodoaniline
OPENEYE Name: 4-fluoro-2-iodo-aniline
IUPAC Name: 4-fluoro-2-iodoaniline
SYSTEMATIC NAME: 4-fluoranyl-2-iodanyl-aniline
MOLECULAR FORMULA: C6H5FIN
MOLECULAR WEIGHT: 237.013473
SMILES: C1=CC(=C(C=C1F)I)N
Structure:
CAS RN: 22409-83-2
CAS Name: 2-phenoxyethyl(triphenyl)phosphonium bromide
OPENEYE Name: 2-phenoxyethyl(triphenyl)phosphonium bromide
IUPAC Name: 2-phenoxyethyl(triphenyl)phosphanium bromide
SYSTEMATIC NAME: 2-phenoxyethyl(triphenyl)phosphanium bromide
MOLECULAR FORMULA: C26H24BrOP
MOLECULAR WEIGHT: 463.345921
SMILES: C1=CC=C(C=C1)OCC[P+](C2=CC=CC=C2)(C3=CC=CC=C3)C4=CC=CC=C4.[Br-]
Structure:
CAS RN: 351003-49-1
CAS Name: 5-chloro-2-fluorobenzenesulfonyl chloride
OPENEYE Name: 5-chloro-2-fluoro-benzenesulfonyl chloride
IUPAC Name: 5-chloro-2-fluorobenzenesulfonyl chloride
SYSTEMATIC NAME: 5-chloranyl-2-fluoranyl-benzenesulfonyl chloride
MOLECULAR FORMULA: C6H3Cl2FO2S
MOLECULAR WEIGHT: 229.056223
SMILES: C1=CC(=C(C=C1Cl)S(=O)(=O)Cl)F
Structure:
CAS RN: 56860-85-6
CAS Name: 1-(difluoromethoxy)-1,1,2,3,3,3-hexafluoropropane
OPENEYE Name: 1-(difluoromethoxy)-1,1,2,3,3,3-hexafluoro-propane
IUPAC Name: 1-(difluoromethoxy)-1,1,2,3,3,3-hexafluoropropane
SYSTEMATIC NAME: 1-[bis(fluoranyl)methoxy]-1,1,2,3,3,3-hexakis(fluoranyl)propane
MOLECULAR FORMULA: C4H2F8O
MOLECULAR WEIGHT: 218.045306
SMILES: C(C(OC(F)F)(F)F)(C(F)(F)F)F
Structure:
CAS RN: 258513-41-6
CAS Name: 2-bromo-1-(2,5-difluorophenyl)ethanone
OPENEYE Name: 2-bromo-1-(2,5-difluorophenyl)ethanone
IUPAC Name: 2-bromo-1-(2,5-difluorophenyl)ethanone
SYSTEMATIC NAME: 1-[2,5-bis(fluoranyl)phenyl]-2-bromanyl-ethanone
MOLECULAR FORMULA: C8H5BrF2O
MOLECULAR WEIGHT: 235.025506
SMILES: C1=CC(=C(C=C1F)C(=O)CBr)F
Structure:
CAS RN: 56159-89-8
CAS Name: 2-bromo-1-(2,6-difluorophenyl)ethanone
OPENEYE Name: 2-bromo-1-(2,6-difluorophenyl)ethanone
IUPAC Name: 2-bromo-1-(2,6-difluorophenyl)ethanone
SYSTEMATIC NAME: 1-[2,6-bis(fluoranyl)phenyl]-2-bromanyl-ethanone
MOLECULAR FORMULA: C8H5BrF2O
MOLECULAR WEIGHT: 235.025506
SMILES: C1=CC(=C(C(=C1)F)C(=O)CBr)F
Structure:
CAS RN: 25271-35-6
CAS Name: 1-methyl-2-piperidinecarboxylic acid hydrochloride
OPENEYE Name: 1-methylpiperidine-2-carboxylic acid hydrochloride
IUPAC Name: 1-methylpiperidine-2-carboxylic acid hydrochloride
SYSTEMATIC NAME: 1-methylpiperidine-2-carboxylic acid hydrochloride
MOLECULAR FORMULA: C7H14ClNO2
MOLECULAR WEIGHT: 179.64456
SMILES: CN1CCCCC1C(=O)O.Cl
Structure:
CAS RN: 151772-59-7
CAS Name: 2,2-difluoro-2-[1,1,2,2-tetrafluoro-2-[1,1,2,2-tetrafluoro-2-(trifluoromethoxy)ethoxy]ethoxy]acetic acid
OPENEYE Name: 2,2-difluoro-2-[1,1,2,2-tetrafluoro-2-[1,1,2,2-tetrafluoro-2-(trifluoromethoxy)ethoxy]ethoxy]acetic acid
IUPAC Name: 2,2-difluoro-2-[1,1,2,2-tetrafluoro-2-[1,1,2,2-tetrafluoro-2-(trifluoromethoxy)ethoxy]ethoxy]acetic acid
SYSTEMATIC NAME: 2,2-bis(fluoranyl)-2-[1,1,2,2-tetrakis(fluoranyl)-2-[1,1,2,2-tetrakis(fluoranyl)-2-(trifluoromethyloxy)ethoxy]ethoxy]ethanoic acid
MOLECULAR FORMULA: C7HF13O5
MOLECULAR WEIGHT: 412.059082
SMILES: C(=O)(C(OC(C(OC(C(OC(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)O
Structure:
CAS RN: 351003-22-0
CAS Name: 2,5-bis(trifluoromethyl)benzenesulfonyl chloride
OPENEYE Name: 2,5-bis(trifluoromethyl)benzenesulfonyl chloride
IUPAC Name: 2,5-bis(trifluoromethyl)benzenesulfonyl chloride
SYSTEMATIC NAME: 2,5-bis(trifluoromethyl)benzenesulfonyl chloride
MOLECULAR FORMULA: C8H3ClF6O2S
MOLECULAR WEIGHT: 312.616639
SMILES: C1=CC(=C(C=C1C(F)(F)F)S(=O)(=O)Cl)C(F)(F)F
Structure:
CAS RN: 146829-79-0
CAS Name: 1,1,2,2-tetrafluoro-2-(1,1,2,2-tetrafluoro-2-fluorosulfonylethoxy)ethanesulfonyl fluoride
OPENEYE Name: 1,1,2,2-tetrafluoro-2-(1,1,2,2-tetrafluoro-2-fluorosulfonyl-ethoxy)ethanesulfonyl fluoride
IUPAC Name: 1,1,2,2-tetrafluoro-2-(1,1,2,2-tetrafluoro-2-fluorosulfonylethoxy)ethanesulfonyl fluoride
SYSTEMATIC NAME: 1,1,2,2-tetrakis(fluoranyl)-2-[1,1,2,2-tetrakis(fluoranyl)-2-fluorosulfonyl-ethoxy]ethanesulfonyl fluoride
MOLECULAR FORMULA: C4F10O5S2
MOLECULAR WEIGHT: 382.153832
SMILES: C(C(F)(F)S(=O)(=O)F)(OC(C(F)(F)S(=O)(=O)F)(F)F)(F)F
Structure:
CAS RN: 63059-25-6
CAS Name: 2-iodobenzenesulfonic acid
OPENEYE Name: 2-iodobenzenesulfonic acid
IUPAC Name: 2-iodobenzenesulfonic acid
SYSTEMATIC NAME: 2-iodanylbenzenesulfonic acid
MOLECULAR FORMULA: C6H5IO3S
MOLECULAR WEIGHT: 284.07157
SMILES: C1=CC=C(C(=C1)S(=O)(=O)O)I
Structure:
CAS RN: 22819-47-2
CAS Name: (3S,4R)-1,1,2,2,3,4-hexafluorocyclobutane
OPENEYE Name: (3S,4R)-1,1,2,2,3,4-hexafluorocyclobutane
IUPAC Name: (3S,4R)-1,1,2,2,3,4-hexafluorocyclobutane
SYSTEMATIC NAME: (3S,4R)-1,1,2,2,3,4-hexakis(fluoranyl)cyclobutane
MOLECULAR FORMULA: C4H2F6
MOLECULAR WEIGHT: 164.049099
SMILES: [C@H]1([C@@H](C(C1(F)F)(F)F)F)F
Structure:
CAS RN: 654-47-7
CAS Name: 1-fluoro-2-methylsulfonylbenzene
OPENEYE Name: 1-fluoro-2-methylsulfonyl-benzene
IUPAC Name: 1-fluoro-2-methylsulfonylbenzene
SYSTEMATIC NAME: 1-fluoranyl-2-methylsulfonyl-benzene
MOLECULAR FORMULA: C7H7FO2S
MOLECULAR WEIGHT: 174.192683
SMILES: CS(=O)(=O)C1=CC=CC=C1F
Structure:
CAS RN: 123843-65-2
CAS Name: 2,6-difluoro-4-methoxybenzoic acid
OPENEYE Name: 2,6-difluoro-4-methoxy-benzoic acid
IUPAC Name: 2,6-difluoro-4-methoxybenzoic acid
SYSTEMATIC NAME: 2,6-bis(fluoranyl)-4-methoxy-benzoic acid
MOLECULAR FORMULA: C8H6F2O3
MOLECULAR WEIGHT: 188.128246
SMILES: COC1=CC(=C(C(=C1)F)C(=O)O)F
Structure:
CAS RN: 351003-34-4
CAS Name: 4-(difluoromethoxy)benzenesulfonyl chloride
OPENEYE Name: 4-(difluoromethoxy)benzenesulfonyl chloride
IUPAC Name: 4-(difluoromethoxy)benzenesulfonyl chloride
SYSTEMATIC NAME: 4-[bis(fluoranyl)methoxy]benzenesulfonyl chloride
MOLECULAR FORMULA: C7H5ClF2O3S
MOLECULAR WEIGHT: 242.627606
SMILES: C1=CC(=CC=C1OC(F)F)S(=O)(=O)Cl
Structure:
CAS RN: 2265-91-0
CAS Name: 1,3-difluoro-5-iodobenzene
OPENEYE Name: 1,3-difluoro-5-iodo-benzene
IUPAC Name: 1,3-difluoro-5-iodobenzene
SYSTEMATIC NAME: 1,3-bis(fluoranyl)-5-iodanyl-benzene
MOLECULAR FORMULA: C6H3F2I
MOLECULAR WEIGHT: 239.989296
SMILES: C1=C(C=C(C=C1F)I)F
Structure:
CAS RN: 72373-82-1
CAS Name: 1-chloro-2-fluoro-3-iodobenzene
OPENEYE Name: 1-chloro-2-fluoro-3-iodo-benzene
IUPAC Name: 1-chloro-2-fluoro-3-iodobenzene
SYSTEMATIC NAME: 1-chloranyl-2-fluoranyl-3-iodanyl-benzene
MOLECULAR FORMULA: C6H3ClFI
MOLECULAR WEIGHT: 256.443893
SMILES: C1=CC(=C(C(=C1)I)F)Cl
Structure:
CAS RN: 351003-51-5
CAS Name: 4-bromo-3-fluorobenzenesulfonyl chloride
OPENEYE Name: 4-bromo-3-fluoro-benzenesulfonyl chloride
IUPAC Name: 4-bromo-3-fluorobenzenesulfonyl chloride
SYSTEMATIC NAME: 4-bromanyl-3-fluoranyl-benzenesulfonyl chloride
MOLECULAR FORMULA: C6H3BrClFO2S
MOLECULAR WEIGHT: 273.507223
SMILES: C1=CC(=C(C=C1S(=O)(=O)Cl)F)Br
Structure:
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