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Trifluoromethylbenzenes

Organic compounds that consist of a phenyl group bonded to a carbon that is bonded to three fluorine atoms in the following structure: C6H5CF3; also known as benzotrifluoride.
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1 – 15 of 59 results
1

2-(Trifluoromethyl)aniline, 97%, Thermo Scientific™

CAS: 88-17-5 Molecular Formula: C7H6F3N Molecular Weight (g/mol): 161.127 MDL Number: MFCD00007718 InChI Key: VBLXCTYLWZJBKA-UHFFFAOYSA-N Synonym: 2-trifluoromethyl aniline,2-aminobenzotrifluoride,o-aminobenzotrifluoride,o-trifluoromethyl aniline,o-trifluoromethylaniline,benzenamine, 2-trifluoromethyl,2-trifluoromethyl benzenamine,alpha,alpha,alpha-trifluoro-o-toluidine,2-aminotrifluorotoluene,2-aminotrifluoromethylbenzene PubChem CID: 6922 IUPAC Name: 2-(trifluoromethyl)aniline SMILES: C1=CC=C(C(=C1)C(F)(F)F)N

PubChem CID 6922
CAS 88-17-5
Molecular Weight (g/mol) 161.127
MDL Number MFCD00007718
SMILES C1=CC=C(C(=C1)C(F)(F)F)N
Synonym 2-trifluoromethyl aniline,2-aminobenzotrifluoride,o-aminobenzotrifluoride,o-trifluoromethyl aniline,o-trifluoromethylaniline,benzenamine, 2-trifluoromethyl,2-trifluoromethyl benzenamine,alpha,alpha,alpha-trifluoro-o-toluidine,2-aminotrifluorotoluene,2-aminotrifluoromethylbenzene
IUPAC Name 2-(trifluoromethyl)aniline
InChI Key VBLXCTYLWZJBKA-UHFFFAOYSA-N
Molecular Formula C7H6F3N
2

3-Bromo-5-(trifluoromethyl)benzene-1,2-diamine, 97%, Thermo Scientific™

CAS: 113170-72-2 Molecular Formula: C7H6BrF3N2 Molecular Weight (g/mol): 255.038 MDL Number: MFCD00042484 InChI Key: OVGAPUVMLZWQQF-UHFFFAOYSA-N Synonym: 3-bromo-5-trifluoromethyl benzene-1,2-diamine,3-bromo-4,5-diaminobenzotrifluoride,buttpark 82\03-57,1,2-diamino-3-bromo-5-trifluoromethyl benzene,3-bromo-5-trifluoromethyl-1,2-phenylenediamine,2-amino-3-bromo-5-trifluoromethyl phenylamine,3-bromo-5-trifluoromethyl-1,2-benzenediamine,4,5-diamino-3-bromobenzotrifluoride,pubchem2253 PubChem CID: 735785 IUPAC Name: 3-bromo-5-(trifluoromethyl)benzene-1,2-diamine SMILES: C1=C(C=C(C(=C1N)N)Br)C(F)(F)F

PubChem CID 735785
CAS 113170-72-2
Molecular Weight (g/mol) 255.038
MDL Number MFCD00042484
SMILES C1=C(C=C(C(=C1N)N)Br)C(F)(F)F
Synonym 3-bromo-5-trifluoromethyl benzene-1,2-diamine,3-bromo-4,5-diaminobenzotrifluoride,buttpark 82\03-57,1,2-diamino-3-bromo-5-trifluoromethyl benzene,3-bromo-5-trifluoromethyl-1,2-phenylenediamine,2-amino-3-bromo-5-trifluoromethyl phenylamine,3-bromo-5-trifluoromethyl-1,2-benzenediamine,4,5-diamino-3-bromobenzotrifluoride,pubchem2253
IUPAC Name 3-bromo-5-(trifluoromethyl)benzene-1,2-diamine
InChI Key OVGAPUVMLZWQQF-UHFFFAOYSA-N
Molecular Formula C7H6BrF3N2
3

N-Methyl-N-({2-[4-(trifluoromethyl)phenyl]-1,3-thiazol-4-yl}methyl)amine, 97%, Thermo Scientific™

CAS: 857284-26-5 Molecular Formula: C12H11F3N2S Molecular Weight (g/mol): 272.289 MDL Number: MFCD07772873 InChI Key: IBCDDBBGPGTKNC-UHFFFAOYSA-N Synonym: n-methyl-1-2-4-trifluoromethyl phenyl-1,3-thiazol-4-yl methanamine,n-methyl-n-2-4-trifluoromethyl phenyl-1,3-thiazol-4-yl methylamine,n-methyl-n-2-4-trifluoromethyl phenyl-1,3-thiazol-4-yl methyl amine,methyl 2-4-trifluoromethyl phenyl-1,3-thiazol-4-yl methyl amine,n-methyl-1-2-4-trifluoromethyl phenyl-4-thiazolyl methanamine PubChem CID: 7164660 IUPAC Name: N-methyl-1-[2-[4-(trifluoromethyl)phenyl]-1,3-thiazol-4-yl]methanamine SMILES: CNCC1=CSC(=N1)C2=CC=C(C=C2)C(F)(F)F

PubChem CID 7164660
CAS 857284-26-5
Molecular Weight (g/mol) 272.289
MDL Number MFCD07772873
SMILES CNCC1=CSC(=N1)C2=CC=C(C=C2)C(F)(F)F
Synonym n-methyl-1-2-4-trifluoromethyl phenyl-1,3-thiazol-4-yl methanamine,n-methyl-n-2-4-trifluoromethyl phenyl-1,3-thiazol-4-yl methylamine,n-methyl-n-2-4-trifluoromethyl phenyl-1,3-thiazol-4-yl methyl amine,methyl 2-4-trifluoromethyl phenyl-1,3-thiazol-4-yl methyl amine,n-methyl-1-2-4-trifluoromethyl phenyl-4-thiazolyl methanamine
IUPAC Name N-methyl-1-[2-[4-(trifluoromethyl)phenyl]-1,3-thiazol-4-yl]methanamine
InChI Key IBCDDBBGPGTKNC-UHFFFAOYSA-N
Molecular Formula C12H11F3N2S
5

2-Bromo-1-{4-methyl-2-[4-(trifluoromethyl)phenyl]1,3-thiazol-5-yl}-1-ethanone, ≥97%, Thermo Scientific™

CAS: 845885-81-6 Molecular Formula: C13H9BrF3NOS Molecular Weight (g/mol): 364.18 MDL Number: MFCD05664414 InChI Key: XGHUMHHAMHEPCS-UHFFFAOYSA-N Synonym: 2-bromo-1-4-methyl-2-4-trifluoromethyl phenyl-1,3-thiazol-5-yl-1-ethanone,2-bromo-1-4-methyl-2-4-trifluoromethyl phenyl-1,3-thiazol-5-yl ethanone,2-bromo-1-4-methyl-2-4-trifluoromethyl phenyl thiazol-5-yl ethanone,ethanone,2-bromo-1-4-methyl-2-4-trifluoromethyl phenyl-5-thiazolyl PubChem CID: 2794631 IUPAC Name: 2-bromo-1-[4-methyl-2-[4-(trifluoromethyl)phenyl]-1,3-thiazol-5-yl]ethanone SMILES: CC1=C(SC(=N1)C2=CC=C(C=C2)C(F)(F)F)C(=O)CBr

PubChem CID 2794631
CAS 845885-81-6
Molecular Weight (g/mol) 364.18
MDL Number MFCD05664414
SMILES CC1=C(SC(=N1)C2=CC=C(C=C2)C(F)(F)F)C(=O)CBr
Synonym 2-bromo-1-4-methyl-2-4-trifluoromethyl phenyl-1,3-thiazol-5-yl-1-ethanone,2-bromo-1-4-methyl-2-4-trifluoromethyl phenyl-1,3-thiazol-5-yl ethanone,2-bromo-1-4-methyl-2-4-trifluoromethyl phenyl thiazol-5-yl ethanone,ethanone,2-bromo-1-4-methyl-2-4-trifluoromethyl phenyl-5-thiazolyl
IUPAC Name 2-bromo-1-[4-methyl-2-[4-(trifluoromethyl)phenyl]-1,3-thiazol-5-yl]ethanone
InChI Key XGHUMHHAMHEPCS-UHFFFAOYSA-N
Molecular Formula C13H9BrF3NOS
7

4-(Trifluoromethyl)benzene-1-sulfonyl chloride, 97%, Thermo Scientific™

CAS: 2991-42-6 Molecular Formula: C7H4ClF3O2S Molecular Weight (g/mol): 244.61 MDL Number: MFCD00042422 InChI Key: OZDCZHDOIBUGAJ-UHFFFAOYSA-N Synonym: 4-trifluoromethyl benzenesulfonyl chloride,4-trifluoromethyl benzene-1-sulfonyl chloride,4-trifluoromethyl benzene sulfonyl chloride,p-trifluoromethylbenzenesulfonyl chloride,4-trifluoromethyl benzenesulfonylchloride,4-trifluoromethyl-benzenesulfonyl chloride,4-trifluoromethyl phenylsulfonyl chloride,p-trifluoromethyl benzenesulfonyl chloride,4-trifluoromethyl benzenesulphonyl chloride,benzenesulfonyl chloride, 4-trifluoromethyl PubChem CID: 2777399 IUPAC Name: 4-(trifluoromethyl)benzenesulfonyl chloride SMILES: FC(F)(F)C1=CC=C(C=C1)S(Cl)(=O)=O

PubChem CID 2777399
CAS 2991-42-6
Molecular Weight (g/mol) 244.61
MDL Number MFCD00042422
SMILES FC(F)(F)C1=CC=C(C=C1)S(Cl)(=O)=O
Synonym 4-trifluoromethyl benzenesulfonyl chloride,4-trifluoromethyl benzene-1-sulfonyl chloride,4-trifluoromethyl benzene sulfonyl chloride,p-trifluoromethylbenzenesulfonyl chloride,4-trifluoromethyl benzenesulfonylchloride,4-trifluoromethyl-benzenesulfonyl chloride,4-trifluoromethyl phenylsulfonyl chloride,p-trifluoromethyl benzenesulfonyl chloride,4-trifluoromethyl benzenesulphonyl chloride,benzenesulfonyl chloride, 4-trifluoromethyl
IUPAC Name 4-(trifluoromethyl)benzenesulfonyl chloride
InChI Key OZDCZHDOIBUGAJ-UHFFFAOYSA-N
Molecular Formula C7H4ClF3O2S
8

2-chloro-5-(trifluoromethyl)benzene-1-sulfonyl chloride, 97%, Thermo Scientific™

CAS: 54090-08-3 Molecular Formula: C7H3Cl2F3O2S Molecular Weight (g/mol): 279.054 MDL Number: MFCD00052310 InChI Key: ZEYKLMDPUOVUCR-UHFFFAOYSA-N Synonym: 2-chloro-5-trifluoromethyl benzenesulfonyl chloride,2-chloro-5-trifluoromethyl benzene-1-sulfonyl chloride,2-chloro-5-trifluoromethyl benzenesulphonylchloride,2-chloro-5-trifluoromethyl benzenesulfonylchloride,chloro 2-chloro-5-trifluoromethyl phenyl sulfone,pubchem5106,acmc-209lcy,2-chloro-5-trifluoromethylbenzenesulfonylchloride,2-chloro-5-trifluoromethyl phenylsulfonyl chloride,4-chloro-3-trifluoromethylbenzene sulfonyl chloride PubChem CID: 2734274 IUPAC Name: 2-chloro-5-(trifluoromethyl)benzenesulfonyl chloride SMILES: C1=CC(=C(C=C1C(F)(F)F)S(=O)(=O)Cl)Cl

PubChem CID 2734274
CAS 54090-08-3
Molecular Weight (g/mol) 279.054
MDL Number MFCD00052310
SMILES C1=CC(=C(C=C1C(F)(F)F)S(=O)(=O)Cl)Cl
Synonym 2-chloro-5-trifluoromethyl benzenesulfonyl chloride,2-chloro-5-trifluoromethyl benzene-1-sulfonyl chloride,2-chloro-5-trifluoromethyl benzenesulphonylchloride,2-chloro-5-trifluoromethyl benzenesulfonylchloride,chloro 2-chloro-5-trifluoromethyl phenyl sulfone,pubchem5106,acmc-209lcy,2-chloro-5-trifluoromethylbenzenesulfonylchloride,2-chloro-5-trifluoromethyl phenylsulfonyl chloride,4-chloro-3-trifluoromethylbenzene sulfonyl chloride
IUPAC Name 2-chloro-5-(trifluoromethyl)benzenesulfonyl chloride
InChI Key ZEYKLMDPUOVUCR-UHFFFAOYSA-N
Molecular Formula C7H3Cl2F3O2S
10

2-(trifluoromethyl)phenyl isothiocyanate, Thermo Scientific™

CAS: 1743-86-8 Molecular Formula: C8H4F3NS Molecular Weight (g/mol): 203.182 InChI Key: FCEKLQPJGXIQRY-UHFFFAOYSA-N Synonym: 2-trifluoromethyl phenyl isothiocyanate,1-isothiocyanato-2-trifluoromethyl benzene,2-trifluoromethylphenylisothiocyanate,2-trifluoromethyl phenylisothiocyanate,2-trifluoromethylphenyl isothiocyanate,o-trifluoromethyl phenyl isothiocyanate,1-isothiocyanato-2-trifluoromethyl-benzene,benzene, 1-isothiocyanato-2-trifluoromethyl,alpha,alpha,alpha-trifluoro-o-tolyl isothiocyanate,isothiocyanic acid 2-trifluoromethyl phenyl ester PubChem CID: 737162 IUPAC Name: 1-isothiocyanato-2-(trifluoromethyl)benzene SMILES: C1=CC=C(C(=C1)C(F)(F)F)N=C=S

PubChem CID 737162
CAS 1743-86-8
Molecular Weight (g/mol) 203.182
SMILES C1=CC=C(C(=C1)C(F)(F)F)N=C=S
Synonym 2-trifluoromethyl phenyl isothiocyanate,1-isothiocyanato-2-trifluoromethyl benzene,2-trifluoromethylphenylisothiocyanate,2-trifluoromethyl phenylisothiocyanate,2-trifluoromethylphenyl isothiocyanate,o-trifluoromethyl phenyl isothiocyanate,1-isothiocyanato-2-trifluoromethyl-benzene,benzene, 1-isothiocyanato-2-trifluoromethyl,alpha,alpha,alpha-trifluoro-o-tolyl isothiocyanate,isothiocyanic acid 2-trifluoromethyl phenyl ester
IUPAC Name 1-isothiocyanato-2-(trifluoromethyl)benzene
InChI Key FCEKLQPJGXIQRY-UHFFFAOYSA-N
Molecular Formula C8H4F3NS
11

N'-hydroxy-4-(trifluoromethyl)benzenecarboximidamide, Thermo Scientific™

CAS: 22179-86-8 Molecular Formula: C8H7F3N2O Molecular Weight (g/mol): 204.152 InChI Key: QCVFLUSIBKAKPC-UHFFFAOYSA-N Synonym: 4-trifluoromethyl benzamidoxime,n-hydroxy-4-trifluoromethyl-benzamidine,n'-hydroxy-4-trifluoromethyl benzenecarboximidamide,n'-hydroxy-4-trifluoromethyl benzimidamide,z-n'-hydroxy-4-trifluoromethyl benzimidamide,z-n'-hydroxy-4-trifluoromethyl benzene-1-carboximidamide,4-trifluoromethylbenzamidoxime,hydroxyimino 4-trifluoromethyl phenyl methylamine,4-trifluoromethylbenzamideoxime,benzenecarboximidamide,n-hydroxy-4-trifluoromethyl PubChem CID: 9581576 IUPAC Name: N'-hydroxy-4-(trifluoromethyl)benzenecarboximidamide SMILES: C1=CC(=CC=C1C(=NO)N)C(F)(F)F

PubChem CID 9581576
CAS 22179-86-8
Molecular Weight (g/mol) 204.152
SMILES C1=CC(=CC=C1C(=NO)N)C(F)(F)F
Synonym 4-trifluoromethyl benzamidoxime,n-hydroxy-4-trifluoromethyl-benzamidine,n'-hydroxy-4-trifluoromethyl benzenecarboximidamide,n'-hydroxy-4-trifluoromethyl benzimidamide,z-n'-hydroxy-4-trifluoromethyl benzimidamide,z-n'-hydroxy-4-trifluoromethyl benzene-1-carboximidamide,4-trifluoromethylbenzamidoxime,hydroxyimino 4-trifluoromethyl phenyl methylamine,4-trifluoromethylbenzamideoxime,benzenecarboximidamide,n-hydroxy-4-trifluoromethyl
IUPAC Name N'-hydroxy-4-(trifluoromethyl)benzenecarboximidamide
InChI Key QCVFLUSIBKAKPC-UHFFFAOYSA-N
Molecular Formula C8H7F3N2O
14

2-(Trifluoromethyl)benzenethiol, ≥95%, Thermo Scientific™

CAS: 13333-97-6 Molecular Formula: C7H5F3S Molecular Weight (g/mol): 178.172 MDL Number: MFCD00068896 InChI Key: XVGQHRKNXSUPEF-UHFFFAOYSA-N Synonym: 2-trifluoromethyl benzenethiol,2-trifluoromethyl thiophenol,2-trifluoromethylthiophenol,2-trifluoromethyl benzene-1-thiol,2-mercaptobenzotrifluoride,pubchem6860,acmc-209brx,trifluoromethyl thiophenol,2trifluoromethylbenzenethiol PubChem CID: 2777889 IUPAC Name: 2-(trifluoromethyl)benzenethiol SMILES: C1=CC=C(C(=C1)C(F)(F)F)S

PubChem CID 2777889
CAS 13333-97-6
Molecular Weight (g/mol) 178.172
MDL Number MFCD00068896
SMILES C1=CC=C(C(=C1)C(F)(F)F)S
Synonym 2-trifluoromethyl benzenethiol,2-trifluoromethyl thiophenol,2-trifluoromethylthiophenol,2-trifluoromethyl benzene-1-thiol,2-mercaptobenzotrifluoride,pubchem6860,acmc-209brx,trifluoromethyl thiophenol,2trifluoromethylbenzenethiol
IUPAC Name 2-(trifluoromethyl)benzenethiol
InChI Key XVGQHRKNXSUPEF-UHFFFAOYSA-N
Molecular Formula C7H5F3S