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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 – 9 of 9 results
1

5-Fluoro-2-(trifluoromethyl)benzylamine, 97%, Thermo Scientific™

CAS: 231291-14-8 Molecular Formula: C8H7F4N Molecular Weight (g/mol): 193.145 MDL Number: MFCD00236288 InChI Key: ZRDWPCJUMDGSCG-UHFFFAOYSA-N Synonym: 5-fluoro-2-trifluoromethyl benzylamine,5-fluoro-2-trifluoromethyl phenyl methanamine,5-fluoro-2-trifluoromethyl phenyl methylamine,1-5-fluoro-2-trifluoromethyl phenyl methanamine,acmc-1cqk1,ksc494q0r,2-trifluoromethyl-5-fluorobenzylamine,5-fluoro-2-trifluoromethylbenzylamine,5-fluoro-2-trifluoromethyl phenyl methamine PubChem CID: 2737568 IUPAC Name: [5-fluoro-2-(trifluoromethyl)phenyl]methanamine SMILES: C1=CC(=C(C=C1F)CN)C(F)(F)F

PubChem CID 2737568
CAS 231291-14-8
Molecular Weight (g/mol) 193.145
MDL Number MFCD00236288
SMILES C1=CC(=C(C=C1F)CN)C(F)(F)F
Synonym 5-fluoro-2-trifluoromethyl benzylamine,5-fluoro-2-trifluoromethyl phenyl methanamine,5-fluoro-2-trifluoromethyl phenyl methylamine,1-5-fluoro-2-trifluoromethyl phenyl methanamine,acmc-1cqk1,ksc494q0r,2-trifluoromethyl-5-fluorobenzylamine,5-fluoro-2-trifluoromethylbenzylamine,5-fluoro-2-trifluoromethyl phenyl methamine
IUPAC Name [5-fluoro-2-(trifluoromethyl)phenyl]methanamine
InChI Key ZRDWPCJUMDGSCG-UHFFFAOYSA-N
Molecular Formula C8H7F4N
2

2-(Trifluoromethyl)benzaldehyde, 98%

CAS: 447-61-0 Molecular Formula: C8H5F3O Molecular Weight (g/mol): 174.122 MDL Number: MFCD00003337 InChI Key: ZDVRPKUWYQVVDX-UHFFFAOYSA-N Synonym: 2-trifluoromethyl benzaldehyde,o-trifluoromethyl benzaldehyde,o-trifluoromethylbenzaldehyde,alpha,alpha,alpha-trifluoro-o-tolualdehyde,benzaldehyde, 2-trifluoromethyl,2-trifluoromethyl-benzaldehyde,ortho-trifluoromethyl-benzaldehyde,otf-bad,trifluoromethylbenzaldehyde PubChem CID: 123067 IUPAC Name: 2-(trifluoromethyl)benzaldehyde SMILES: C1=CC=C(C(=C1)C=O)C(F)(F)F

PubChem CID 123067
CAS 447-61-0
Molecular Weight (g/mol) 174.122
MDL Number MFCD00003337
SMILES C1=CC=C(C(=C1)C=O)C(F)(F)F
Synonym 2-trifluoromethyl benzaldehyde,o-trifluoromethyl benzaldehyde,o-trifluoromethylbenzaldehyde,alpha,alpha,alpha-trifluoro-o-tolualdehyde,benzaldehyde, 2-trifluoromethyl,2-trifluoromethyl-benzaldehyde,ortho-trifluoromethyl-benzaldehyde,otf-bad,trifluoromethylbenzaldehyde
IUPAC Name 2-(trifluoromethyl)benzaldehyde
InChI Key ZDVRPKUWYQVVDX-UHFFFAOYSA-N
Molecular Formula C8H5F3O
3

alpha,alpha,alpha-Trifluoro-m-cresol, 98+%

CAS: 98-17-9 Molecular Formula: C7H5F3O Molecular Weight (g/mol): 162.11 MDL Number: MFCD00002299 InChI Key: UGEJOEBBMPOJMT-UHFFFAOYSA-N Synonym: 3-trifluoromethyl phenol,3-hydroxybenzotrifluoride,m-trifluoromethylphenol,m-hydroxybenzotrifluoride,phenol, 3-trifluoromethyl,m-trifluoromethyl phenol,alpha,alpha,alpha-trifluoro-m-cresol,a,a,a-trifluoro-m-cresol PubChem CID: 7376 IUPAC Name: 3-(trifluoromethyl)phenol SMILES: C1=CC(=CC(=C1)O)C(F)(F)F

PubChem CID 7376
CAS 98-17-9
Molecular Weight (g/mol) 162.11
MDL Number MFCD00002299
SMILES C1=CC(=CC(=C1)O)C(F)(F)F
Synonym 3-trifluoromethyl phenol,3-hydroxybenzotrifluoride,m-trifluoromethylphenol,m-hydroxybenzotrifluoride,phenol, 3-trifluoromethyl,m-trifluoromethyl phenol,alpha,alpha,alpha-trifluoro-m-cresol,a,a,a-trifluoro-m-cresol
IUPAC Name 3-(trifluoromethyl)phenol
InChI Key UGEJOEBBMPOJMT-UHFFFAOYSA-N
Molecular Formula C7H5F3O
4

alpha,alpha,alpha-Trifluorotoluene, 99+%

CAS: 98-08-8 Molecular Formula: C7H5F3 Molecular Weight (g/mol): 146.11 MDL Number: MFCD00000372 InChI Key: GETTZEONDQJALK-UHFFFAOYSA-N Synonym: benzotrifluoride,trifluoromethyl benzene,alpha,alpha,alpha-trifluorotoluene,phenylfluoroform,benzene, trifluoromethyl,benzenyl fluoride,benzylidyne fluoride,usaf ma-16,a,a,a-trifluorotoluene,trifluoro toluene PubChem CID: 7368 ChEBI: CHEBI:36810 IUPAC Name: trifluoromethylbenzene SMILES: C1=CC=C(C=C1)C(F)(F)F

PubChem CID 7368
CAS 98-08-8
Molecular Weight (g/mol) 146.11
ChEBI CHEBI:36810
MDL Number MFCD00000372
SMILES C1=CC=C(C=C1)C(F)(F)F
Synonym benzotrifluoride,trifluoromethyl benzene,alpha,alpha,alpha-trifluorotoluene,phenylfluoroform,benzene, trifluoromethyl,benzenyl fluoride,benzylidyne fluoride,usaf ma-16,a,a,a-trifluorotoluene,trifluoro toluene
IUPAC Name trifluoromethylbenzene
InChI Key GETTZEONDQJALK-UHFFFAOYSA-N
Molecular Formula C7H5F3
5

4-Chloro-3-nitrobenzotrifluoride, 98%, Thermo Scientific™

CAS: 121-17-5 Molecular Formula: C7H3ClF3NO2 Molecular Weight (g/mol): 225.55 MDL Number: MFCD00007084 InChI Key: TZGFQIXRVUHDLE-UHFFFAOYSA-N Synonym: 4-chloro-3-nitrobenzotrifluoride,1-chloro-2-nitro-4-trifluoromethyl benzene,3-nitro-4-chlorobenzotrifluoride,2-chloro-5-trifluoromethyl nitrobenzene,benzene, 1-chloro-2-nitro-4-trifluoromethyl,cmnt,2-nitro-4-trifluoromethylchlorobenzene,3-nitro-4-chlorotrifluoromethylbenzene,4-chloro-3-nitro-a,a,a-trifluorotoluene,4-chloro-3-nitrobenzylidyne fluoride PubChem CID: 8462 IUPAC Name: 1-chloro-2-nitro-4-(trifluoromethyl)benzene SMILES: [O-][N+](=O)C1=CC(=CC=C1Cl)C(F)(F)F

PubChem CID 8462
CAS 121-17-5
Molecular Weight (g/mol) 225.55
MDL Number MFCD00007084
SMILES [O-][N+](=O)C1=CC(=CC=C1Cl)C(F)(F)F
Synonym 4-chloro-3-nitrobenzotrifluoride,1-chloro-2-nitro-4-trifluoromethyl benzene,3-nitro-4-chlorobenzotrifluoride,2-chloro-5-trifluoromethyl nitrobenzene,benzene, 1-chloro-2-nitro-4-trifluoromethyl,cmnt,2-nitro-4-trifluoromethylchlorobenzene,3-nitro-4-chlorotrifluoromethylbenzene,4-chloro-3-nitro-a,a,a-trifluorotoluene,4-chloro-3-nitrobenzylidyne fluoride
IUPAC Name 1-chloro-2-nitro-4-(trifluoromethyl)benzene
InChI Key TZGFQIXRVUHDLE-UHFFFAOYSA-N
Molecular Formula C7H3ClF3NO2
6

α,α,α-Trifluorotoluene, ≥99%, Honeywell™

CAS: 98-08-8 Molecular Formula: C7H5F3 Molecular Weight (g/mol): 146.112 MDL Number: MFCD00000372 InChI Key: GETTZEONDQJALK-UHFFFAOYSA-N Synonym: benzotrifluoride,trifluoromethyl benzene,alpha,alpha,alpha-trifluorotoluene,phenylfluoroform,benzene, trifluoromethyl,benzenyl fluoride,benzylidyne fluoride,usaf ma-16,a,a,a-trifluorotoluene,trifluoro toluene PubChem CID: 7368 ChEBI: CHEBI:36810 IUPAC Name: trifluoromethylbenzene SMILES: C1=CC=C(C=C1)C(F)(F)F

PubChem CID 7368
CAS 98-08-8
Molecular Weight (g/mol) 146.112
ChEBI CHEBI:36810
MDL Number MFCD00000372
SMILES C1=CC=C(C=C1)C(F)(F)F
Synonym benzotrifluoride,trifluoromethyl benzene,alpha,alpha,alpha-trifluorotoluene,phenylfluoroform,benzene, trifluoromethyl,benzenyl fluoride,benzylidyne fluoride,usaf ma-16,a,a,a-trifluorotoluene,trifluoro toluene
IUPAC Name trifluoromethylbenzene
InChI Key GETTZEONDQJALK-UHFFFAOYSA-N
Molecular Formula C7H5F3
7

3-Chloro-2-fluoro-5-(trifluoromethyl)benzoic acid, 97%, Thermo Scientific™

CAS: 129931-45-9 Molecular Formula: C8H3ClF4O2 Molecular Weight (g/mol): 242.554 MDL Number: MFCD01631509 InChI Key: UINXNXRHKMRASA-UHFFFAOYSA-N Synonym: 3-chloro-2-fluoro-5-trifluoromethyl benzoic acid,rarechem al be 0499,3-chloro-2-fluoro-5-trifluoromethyl-benzoic acid,pubchem4559,acmc-20a41y,2-fluoro-3-chloro-5-trifluoromethyl-benzoic acid,benzoic acid,3-chloro-2-fluoro-5-trifluoromethyl,3-chloro-2-fluoro-5-trifluoromethyl benzoicacid PubChem CID: 2773751 IUPAC Name: 3-chloro-2-fluoro-5-(trifluoromethyl)benzoic acid SMILES: C1=C(C=C(C(=C1Cl)F)C(=O)O)C(F)(F)F

PubChem CID 2773751
CAS 129931-45-9
Molecular Weight (g/mol) 242.554
MDL Number MFCD01631509
SMILES C1=C(C=C(C(=C1Cl)F)C(=O)O)C(F)(F)F
Synonym 3-chloro-2-fluoro-5-trifluoromethyl benzoic acid,rarechem al be 0499,3-chloro-2-fluoro-5-trifluoromethyl-benzoic acid,pubchem4559,acmc-20a41y,2-fluoro-3-chloro-5-trifluoromethyl-benzoic acid,benzoic acid,3-chloro-2-fluoro-5-trifluoromethyl,3-chloro-2-fluoro-5-trifluoromethyl benzoicacid
IUPAC Name 3-chloro-2-fluoro-5-(trifluoromethyl)benzoic acid
InChI Key UINXNXRHKMRASA-UHFFFAOYSA-N
Molecular Formula C8H3ClF4O2
8

3,5-Bis(trifluoromethyl)benzaldehyde, 97%, Thermo Scientific™

CAS: 401-95-6 Molecular Formula: C9H4F6O Molecular Weight (g/mol): 242.12 MDL Number: MFCD00010206 InChI Key: LDWLIXZSDPXYDR-UHFFFAOYSA-N Synonym: 3,5-bis trifluoromethyl benzaldehyde,3,5-di trifluoromethyl benzaldehyde,mbt-bad,benzaldehyde, 3,5-bis trifluoromethyl,3,5-bis-trifluoromethyl-benzaldehyde,3,5-bis-trifluoromethyl benzaldehyde,pubchem4162,acmc-1ajhv,ksc490m1j PubChem CID: 136247 IUPAC Name: 3,5-bis(trifluoromethyl)benzaldehyde SMILES: C1=C(C=C(C=C1C(F)(F)F)C(F)(F)F)C=O

PubChem CID 136247
CAS 401-95-6
Molecular Weight (g/mol) 242.12
MDL Number MFCD00010206
SMILES C1=C(C=C(C=C1C(F)(F)F)C(F)(F)F)C=O
Synonym 3,5-bis trifluoromethyl benzaldehyde,3,5-di trifluoromethyl benzaldehyde,mbt-bad,benzaldehyde, 3,5-bis trifluoromethyl,3,5-bis-trifluoromethyl-benzaldehyde,3,5-bis-trifluoromethyl benzaldehyde,pubchem4162,acmc-1ajhv,ksc490m1j
IUPAC Name 3,5-bis(trifluoromethyl)benzaldehyde
InChI Key LDWLIXZSDPXYDR-UHFFFAOYSA-N
Molecular Formula C9H4F6O
9

2-Iodobenzotrifluoride, 99%, Thermo Scientific™

CAS: 444-29-1 Molecular Formula: C7H4F3I Molecular Weight (g/mol): 272.01 MDL Number: MFCD00001041 InChI Key: IGZGUYVVBABKOY-UHFFFAOYSA-N Synonym: 2-iodobenzotrifluoride,1-iodo-2-trifluoromethyl benzene,o-iodobenzotrifluoride,benzene, 1-iodo-2-trifluoromethyl,2-iodobenztrifluoride,o-trifluoromethyliodobenzene,2-iodo-alpha,alpha,alpha-trifluorotoluene,iodobenzotrifluoride,2-iodo-a,a,a-trifluorotoluene,2-iodobenzotrifloride PubChem CID: 67957 IUPAC Name: 1-iodo-2-(trifluoromethyl)benzene SMILES: C1=CC=C(C(=C1)C(F)(F)F)I

PubChem CID 67957
CAS 444-29-1
Molecular Weight (g/mol) 272.01
MDL Number MFCD00001041
SMILES C1=CC=C(C(=C1)C(F)(F)F)I
Synonym 2-iodobenzotrifluoride,1-iodo-2-trifluoromethyl benzene,o-iodobenzotrifluoride,benzene, 1-iodo-2-trifluoromethyl,2-iodobenztrifluoride,o-trifluoromethyliodobenzene,2-iodo-alpha,alpha,alpha-trifluorotoluene,iodobenzotrifluoride,2-iodo-a,a,a-trifluorotoluene,2-iodobenzotrifloride
IUPAC Name 1-iodo-2-(trifluoromethyl)benzene
InChI Key IGZGUYVVBABKOY-UHFFFAOYSA-N
Molecular Formula C7H4F3I