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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
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4-(Trifluoromethyl)benzyl alcohol, 98%

CAS: 349-95-1 Molecular Formula: C8H7F3O Molecular Weight (g/mol): 176.138 MDL Number: MFCD00004661 InChI Key: MOOUWXDQAUXZRG-UHFFFAOYSA-N Synonym: 4-trifluoromethyl benzyl alcohol,4-trifluoromethyl phenyl methanol,p-trifluoromethylbenzyl alcohol,4-trifluoromethyl benzene methanol,4-trifluoromethyl benzylic alcohol,benzenemethanol, 4-trifluoromethyl,4-trifluoromethylbenzyl alcohol,ccris 5117,4-trifluoromethyl benzylalcohol PubChem CID: 67684 IUPAC Name: [4-(trifluoromethyl)phenyl]methanol SMILES: C1=CC(=CC=C1CO)C(F)(F)F

PubChem CID 67684
CAS 349-95-1
Molecular Weight (g/mol) 176.138
MDL Number MFCD00004661
SMILES C1=CC(=CC=C1CO)C(F)(F)F
Synonym 4-trifluoromethyl benzyl alcohol,4-trifluoromethyl phenyl methanol,p-trifluoromethylbenzyl alcohol,4-trifluoromethyl benzene methanol,4-trifluoromethyl benzylic alcohol,benzenemethanol, 4-trifluoromethyl,4-trifluoromethylbenzyl alcohol,ccris 5117,4-trifluoromethyl benzylalcohol
IUPAC Name [4-(trifluoromethyl)phenyl]methanol
InChI Key MOOUWXDQAUXZRG-UHFFFAOYSA-N
Molecular Formula C8H7F3O
2

4-Fluoro-2-(trifluoromethyl)benzenesulfonyl Chloride 98.0+%, TCI America™

CAS: 176225-09-5 Molecular Formula: C7H3ClF4O2S Molecular Weight (g/mol): 262.603 MDL Number: MFCD01091000 InChI Key: IGMYEVQPXWKFQF-UHFFFAOYSA-N Synonym: 4-fluoro-2-trifluoromethyl benzenesulfonyl chloride,4-fluoro-2-trifluoromethyl benzene-1-sulfonyl chloride,4-fluoro-2-trifluoromethyl-benzenesulfonyl chloride,4-fluoro-2-trifluoromethyl benzenesulphonyl chloride,2-chlorosulphonyl-4-fluorobenzotrifluoride,4-fluoro-2-trifluoromethyl-benzenesulfonylchloride,4-fluoro-2-trifluoromethyl benzene sulphonyl chloride,pubchem4276,acmc-1c2ls,2-chlorosulphonyl-5-fluorobenzotrifluoride PubChem CID: 2737548 IUPAC Name: 4-fluoro-2-(trifluoromethyl)benzenesulfonyl chloride SMILES: C1=CC(=C(C=C1F)C(F)(F)F)S(=O)(=O)Cl

PubChem CID 2737548
CAS 176225-09-5
Molecular Weight (g/mol) 262.603
MDL Number MFCD01091000
SMILES C1=CC(=C(C=C1F)C(F)(F)F)S(=O)(=O)Cl
Synonym 4-fluoro-2-trifluoromethyl benzenesulfonyl chloride,4-fluoro-2-trifluoromethyl benzene-1-sulfonyl chloride,4-fluoro-2-trifluoromethyl-benzenesulfonyl chloride,4-fluoro-2-trifluoromethyl benzenesulphonyl chloride,2-chlorosulphonyl-4-fluorobenzotrifluoride,4-fluoro-2-trifluoromethyl-benzenesulfonylchloride,4-fluoro-2-trifluoromethyl benzene sulphonyl chloride,pubchem4276,acmc-1c2ls,2-chlorosulphonyl-5-fluorobenzotrifluoride
IUPAC Name 4-fluoro-2-(trifluoromethyl)benzenesulfonyl chloride
InChI Key IGMYEVQPXWKFQF-UHFFFAOYSA-N
Molecular Formula C7H3ClF4O2S
3

4-Fluoro-2-(trifluoromethyl)benzaldehyde 98.0+%, TCI America™

CAS: 90176-80-0 Molecular Formula: C8H4F4O Molecular Weight (g/mol): 192.113 InChI Key: NONOHEMDNFTKCZ-UHFFFAOYSA-N Synonym: 4-fluoro-2-trifluoromethyl benzaldehyde,2-trifluoromethyl-4-fluorobenzaldehyde,4-fluoro-2-trifluoromethyl-benzaldehyde,benzaldehyde, 4-fluoro-2-trifluoromethyl,5-fluoro-2-formylbenzotrifluoride,alpha,alpha,alpha,4-tetrafluoro-o-tolualdehyde,pubchem4241,ksc487q2t,paragos 530044 PubChem CID: 522940 IUPAC Name: 4-fluoro-2-(trifluoromethyl)benzaldehyde SMILES: C1=CC(=C(C=C1F)C(F)(F)F)C=O

PubChem CID 522940
CAS 90176-80-0
Molecular Weight (g/mol) 192.113
SMILES C1=CC(=C(C=C1F)C(F)(F)F)C=O
Synonym 4-fluoro-2-trifluoromethyl benzaldehyde,2-trifluoromethyl-4-fluorobenzaldehyde,4-fluoro-2-trifluoromethyl-benzaldehyde,benzaldehyde, 4-fluoro-2-trifluoromethyl,5-fluoro-2-formylbenzotrifluoride,alpha,alpha,alpha,4-tetrafluoro-o-tolualdehyde,pubchem4241,ksc487q2t,paragos 530044
IUPAC Name 4-fluoro-2-(trifluoromethyl)benzaldehyde
InChI Key NONOHEMDNFTKCZ-UHFFFAOYSA-N
Molecular Formula C8H4F4O
4

3-Chloro-4-iodobenzotrifluoride (stabilized with Copper chip) 97.0+%, TCI America™

CAS: 141738-80-9 Molecular Formula: C7H3ClF3I Molecular Weight (g/mol): 306.45 MDL Number: MFCD00042562 InChI Key: ULJRBVGSKAKZKQ-UHFFFAOYSA-N Synonym: 3-chloro-4-iodobenzotrifluoride,2-chloro-1-iodo-4-trifluoromethyl benzene,2-chloro-4-trifluoromethyl iodobenzene,benzene, 2-chloro-1-iodo-4-trifluoromethyl,pubchem1973,acmc-209cms,buttpark 9857-21,2-chloro-4-trifluoromethyliodobenzene PubChem CID: 2736612 IUPAC Name: 2-chloro-1-iodo-4-(trifluoromethyl)benzene SMILES: FC(F)(F)C1=CC=C(I)C(Cl)=C1

PubChem CID 2736612
CAS 141738-80-9
Molecular Weight (g/mol) 306.45
MDL Number MFCD00042562
SMILES FC(F)(F)C1=CC=C(I)C(Cl)=C1
Synonym 3-chloro-4-iodobenzotrifluoride,2-chloro-1-iodo-4-trifluoromethyl benzene,2-chloro-4-trifluoromethyl iodobenzene,benzene, 2-chloro-1-iodo-4-trifluoromethyl,pubchem1973,acmc-209cms,buttpark 9857-21,2-chloro-4-trifluoromethyliodobenzene
IUPAC Name 2-chloro-1-iodo-4-(trifluoromethyl)benzene
InChI Key ULJRBVGSKAKZKQ-UHFFFAOYSA-N
Molecular Formula C7H3ClF3I
5
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1-Nitro-3,5-bis(trifluoromethyl)benzene, 96%

CAS: 328-75-6 Molecular Formula: C8H3F6NO2 Molecular Weight (g/mol): 259.11 MDL Number: MFCD00000384 InChI Key: GMUWJDVVXLBMEZ-UHFFFAOYSA-N Synonym: 1-nitro-3,5-bis trifluoromethyl benzene,3,5-bis trifluoromethyl nitrobenzene,1,3-bis trifluoromethyl-5-nitrobenzene,3,5-di trifluoromethyl nitrobenzene,benzene, 1-nitro-3,5-bis trifluoromethyl,3,5-bis-trifluoromethylnitrobenzene,3,5-di trifluoromethylnitro benzene,3,5-bis-trifluoromethyl nitrobenzene,5-nitro-1,3-bis trifluoromethyl benzene,alpha,alpha,alpha,alpha',alpha',alpha'-hexafluoro-5-nitroxylene PubChem CID: 67603 IUPAC Name: 1-nitro-3,5-bis(trifluoromethyl)benzene SMILES: [O-][N+](=O)C1=CC(=CC(=C1)C(F)(F)F)C(F)(F)F

PubChem CID 67603
CAS 328-75-6
Molecular Weight (g/mol) 259.11
MDL Number MFCD00000384
SMILES [O-][N+](=O)C1=CC(=CC(=C1)C(F)(F)F)C(F)(F)F
Synonym 1-nitro-3,5-bis trifluoromethyl benzene,3,5-bis trifluoromethyl nitrobenzene,1,3-bis trifluoromethyl-5-nitrobenzene,3,5-di trifluoromethyl nitrobenzene,benzene, 1-nitro-3,5-bis trifluoromethyl,3,5-bis-trifluoromethylnitrobenzene,3,5-di trifluoromethylnitro benzene,3,5-bis-trifluoromethyl nitrobenzene,5-nitro-1,3-bis trifluoromethyl benzene,alpha,alpha,alpha,alpha',alpha',alpha'-hexafluoro-5-nitroxylene
IUPAC Name 1-nitro-3,5-bis(trifluoromethyl)benzene
InChI Key GMUWJDVVXLBMEZ-UHFFFAOYSA-N
Molecular Formula C8H3F6NO2
6

4-(Trifluoromethyl)benzyl Alcohol 96.0+%, TCI America™

CAS: 349-95-1 Molecular Formula: C8H7F3O Molecular Weight (g/mol): 176.138 MDL Number: MFCD00004661 InChI Key: MOOUWXDQAUXZRG-UHFFFAOYSA-N Synonym: 4-trifluoromethyl benzyl alcohol,4-trifluoromethyl phenyl methanol,p-trifluoromethylbenzyl alcohol,4-trifluoromethyl benzene methanol,4-trifluoromethyl benzylic alcohol,benzenemethanol, 4-trifluoromethyl,4-trifluoromethylbenzyl alcohol,ccris 5117,4-trifluoromethyl benzylalcohol PubChem CID: 67684 IUPAC Name: [4-(trifluoromethyl)phenyl]methanol SMILES: C1=CC(=CC=C1CO)C(F)(F)F

PubChem CID 67684
CAS 349-95-1
Molecular Weight (g/mol) 176.138
MDL Number MFCD00004661
SMILES C1=CC(=CC=C1CO)C(F)(F)F
Synonym 4-trifluoromethyl benzyl alcohol,4-trifluoromethyl phenyl methanol,p-trifluoromethylbenzyl alcohol,4-trifluoromethyl benzene methanol,4-trifluoromethyl benzylic alcohol,benzenemethanol, 4-trifluoromethyl,4-trifluoromethylbenzyl alcohol,ccris 5117,4-trifluoromethyl benzylalcohol
IUPAC Name [4-(trifluoromethyl)phenyl]methanol
InChI Key MOOUWXDQAUXZRG-UHFFFAOYSA-N
Molecular Formula C8H7F3O
7

Ethyl 4-(Trifluoromethyl)benzoate 98.0+%, TCI America™

CAS: 583-02-8 Molecular Formula: C10H9F3O2 Molecular Weight (g/mol): 218.175 MDL Number: MFCD00013563 InChI Key: ZQDADDSPMCHZPX-UHFFFAOYSA-N Synonym: ethyl 4-trifluoromethyl benzoate,4-trifluoromethyl benzoic acid ethyl ester,4-trifluoromethylbenzoic acid, ethyl ester,pubchem16913,acmc-1cs5c,ethyl-p-trifluoromethylbenzoate,ethyl-4-trifluoromethyl benzoate,4-trifluoromethylbenzoic acid ethyl ester PubChem CID: 521827 IUPAC Name: ethyl 4-(trifluoromethyl)benzoate SMILES: CCOC(=O)C1=CC=C(C=C1)C(F)(F)F

PubChem CID 521827
CAS 583-02-8
Molecular Weight (g/mol) 218.175
MDL Number MFCD00013563
SMILES CCOC(=O)C1=CC=C(C=C1)C(F)(F)F
Synonym ethyl 4-trifluoromethyl benzoate,4-trifluoromethyl benzoic acid ethyl ester,4-trifluoromethylbenzoic acid, ethyl ester,pubchem16913,acmc-1cs5c,ethyl-p-trifluoromethylbenzoate,ethyl-4-trifluoromethyl benzoate,4-trifluoromethylbenzoic acid ethyl ester
IUPAC Name ethyl 4-(trifluoromethyl)benzoate
InChI Key ZQDADDSPMCHZPX-UHFFFAOYSA-N
Molecular Formula C10H9F3O2
8
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Ethyl 4-(trifluoromethyl)benzoate, 99%

CAS: 583-02-8 Molecular Formula: C10H9F3O2 Molecular Weight (g/mol): 218.175 MDL Number: MFCD00013563 InChI Key: ZQDADDSPMCHZPX-UHFFFAOYSA-N Synonym: ethyl 4-trifluoromethyl benzoate,4-trifluoromethyl benzoic acid ethyl ester,4-trifluoromethylbenzoic acid, ethyl ester,pubchem16913,acmc-1cs5c,ethyl-p-trifluoromethylbenzoate,ethyl-4-trifluoromethyl benzoate,4-trifluoromethylbenzoic acid ethyl ester PubChem CID: 521827 IUPAC Name: ethyl 4-(trifluoromethyl)benzoate SMILES: CCOC(=O)C1=CC=C(C=C1)C(F)(F)F

PubChem CID 521827
CAS 583-02-8
Molecular Weight (g/mol) 218.175
MDL Number MFCD00013563
SMILES CCOC(=O)C1=CC=C(C=C1)C(F)(F)F
Synonym ethyl 4-trifluoromethyl benzoate,4-trifluoromethyl benzoic acid ethyl ester,4-trifluoromethylbenzoic acid, ethyl ester,pubchem16913,acmc-1cs5c,ethyl-p-trifluoromethylbenzoate,ethyl-4-trifluoromethyl benzoate,4-trifluoromethylbenzoic acid ethyl ester
IUPAC Name ethyl 4-(trifluoromethyl)benzoate
InChI Key ZQDADDSPMCHZPX-UHFFFAOYSA-N
Molecular Formula C10H9F3O2
9

4-Nitro-3-(trifluoromethyl)phenol 99.0+%, TCI America™

CAS: 88-30-2 Molecular Formula: C7H4F3NO3 Molecular Weight (g/mol): 207.108 MDL Number: MFCD00014714 InChI Key: ZEFMBAFMCSYJOO-UHFFFAOYSA-N Synonym: 4-nitro-3-trifluoromethyl phenol,lamprecide,lamprecid,5-hydroxy-2-nitrobenzotrifluoride,dowlap f,3-trifluoromethyl-4-nitrophenol,phenol, 4-nitro-3-trifluoromethyl,usaf ma-6,caswell no. 890,tfm piscicide PubChem CID: 6931 IUPAC Name: 4-nitro-3-(trifluoromethyl)phenol SMILES: C1=CC(=C(C=C1O)C(F)(F)F)[N+](=O)[O-]

PubChem CID 6931
CAS 88-30-2
Molecular Weight (g/mol) 207.108
MDL Number MFCD00014714
SMILES C1=CC(=C(C=C1O)C(F)(F)F)[N+](=O)[O-]
Synonym 4-nitro-3-trifluoromethyl phenol,lamprecide,lamprecid,5-hydroxy-2-nitrobenzotrifluoride,dowlap f,3-trifluoromethyl-4-nitrophenol,phenol, 4-nitro-3-trifluoromethyl,usaf ma-6,caswell no. 890,tfm piscicide
IUPAC Name 4-nitro-3-(trifluoromethyl)phenol
InChI Key ZEFMBAFMCSYJOO-UHFFFAOYSA-N
Molecular Formula C7H4F3NO3
10
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4-(Trifluoromethyl)benzylamine, 97%

CAS: 3300-51-4 Molecular Formula: C8H8F3N Molecular Weight (g/mol): 175.15 MDL Number: MFCD00010220 InChI Key: PRDBLLIPPDOICK-UHFFFAOYSA-N Synonym: 4-trifluoromethyl benzylamine,4-trifluoromethylbenzylamine,4-trifluoromethyl phenyl methanamine,1-4-trifluoromethyl phenyl methanamine,4-trifluoromethyl benzyl amine,p-trifluoromethylbenzyl amine,4-trifluoromethyl-benzylamine,p-trifluoromethyl benzylamine,benzenemethanamine, 4-trifluoromethyl PubChem CID: 76804 SMILES: NCC1=CC=C(C=C1)C(F)(F)F

PubChem CID 76804
CAS 3300-51-4
Molecular Weight (g/mol) 175.15
MDL Number MFCD00010220
SMILES NCC1=CC=C(C=C1)C(F)(F)F
Synonym 4-trifluoromethyl benzylamine,4-trifluoromethylbenzylamine,4-trifluoromethyl phenyl methanamine,1-4-trifluoromethyl phenyl methanamine,4-trifluoromethyl benzyl amine,p-trifluoromethylbenzyl amine,4-trifluoromethyl-benzylamine,p-trifluoromethyl benzylamine,benzenemethanamine, 4-trifluoromethyl
InChI Key PRDBLLIPPDOICK-UHFFFAOYSA-N
Molecular Formula C8H8F3N
11
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4-(Trifluoromethyl)benzaldehyde, 97%

CAS: 455-19-6 Molecular Formula: C8H5F3O Molecular Weight (g/mol): 174.122 MDL Number: MFCD00006952 InChI Key: BEOBZEOPTQQELP-UHFFFAOYSA-N Synonym: 4-trifluoromethyl benzaldehyde,benzaldehyde, 4-trifluoromethyl,p-trifluoromethylbenzaldehyde,p-trifluoromethyl benzaldehyde,alpha,alpha,alpha-trifluoro-p-tolualdehyde,4'-trifluoromethyl benzaldehyde,p-trifluoromethyl-benzaldhyde,4-trifluoromethyl-benzaldehyde PubChem CID: 67996 IUPAC Name: 4-(trifluoromethyl)benzaldehyde SMILES: C1=CC(=CC=C1C=O)C(F)(F)F

PubChem CID 67996
CAS 455-19-6
Molecular Weight (g/mol) 174.122
MDL Number MFCD00006952
SMILES C1=CC(=CC=C1C=O)C(F)(F)F
Synonym 4-trifluoromethyl benzaldehyde,benzaldehyde, 4-trifluoromethyl,p-trifluoromethylbenzaldehyde,p-trifluoromethyl benzaldehyde,alpha,alpha,alpha-trifluoro-p-tolualdehyde,4'-trifluoromethyl benzaldehyde,p-trifluoromethyl-benzaldhyde,4-trifluoromethyl-benzaldehyde
IUPAC Name 4-(trifluoromethyl)benzaldehyde
InChI Key BEOBZEOPTQQELP-UHFFFAOYSA-N
Molecular Formula C8H5F3O
12

Aobchem 4-Fluoro-2-(trifluoromethyl)benzaldehyde, AOBCHEM USA 15775-25G. 90176-80-0. MFCD00061313

4-Fluoro-2-(trifluoromethyl)benzaldehyde, AOBCHEM USA 15775-25G. 90176-80-0. MFCD00061313

ENCOMPASS_PREFERRED
13

eMolecules​ 1822928-76-6 | 1-Bromo-2-[1-(trifluoromethyl)cyclopropyl]benzene | Oakwood Chemical | MFCD28126795 | 265.073 | C10H8BrF3 | 90.000 | FC(F)(F)C1(CC1)c1ccccc1Br | 1g | 534152911

1-Bromo-2-[1-(trifluoromethyl)cyclopropyl]benzene | Oakwood Chemical | 1822928-76-6 | MFCD28126795 | 265.073 | C10H8BrF3 | 90.000 | FC(F)(F)C1(CC1)c1ccccc1Br | 1g | 534152911

ENCOMPASS_PREFERRED
14

eMolecules​ 1391577-80-2 | (S)-1-(4-(Trifluoromethyl)phenyl)propan-1-amine hydrochloride | ChemScene | MFCD12757296 | 239.670 | C10H13ClF3N | 97.000 | Cl.CC[C@H](N)c1ccc(cc1)C(F)(F)F | 100mg | 632326059

(S)-1-(4-(Trifluoromethyl)phenyl)propan-1-amine hydrochloride | ChemScene | 1391577-80-2 | MFCD12757296 | 239.670 | C10H13ClF3N | 97.000 | Cl.CC[C@H](N)c1ccc(cc1)C(F)(F)F | 100mg | 632326059

ENCOMPASS_PREFERRED
15

1-(2-Bromoethyl)-3-(trifluoromethyl)benzene 98.0+%, TCI America™

CAS: 1997-80-4 Molecular Formula: C9H8BrF3 Molecular Weight (g/mol): 253.062 MDL Number: MFCD03092900 InChI Key: AZLYAPKPZBXCGX-UHFFFAOYSA-N Synonym: 1-2-bromoethyl-3-trifluoromethyl benzene,3-trifluoromethyl phenethyl bromide,3-trifluoromethyl phenylethyl bromide,benzene, 1-2-bromoethyl-3-trifluoromethyl,1-bromo-2-3-trifluoromethyl phenyl ethane,acmc-20anht,3-trifluoromethylphenethyl bromide,toluene, m-2-bromoethyl-.alpha.,.alpha.,.alpha.-trifluoro,3-trifluoromethyl phenylethylbromide PubChem CID: 594535 IUPAC Name: 1-(2-bromoethyl)-3-(trifluoromethyl)benzene SMILES: C1=CC(=CC(=C1)C(F)(F)F)CCBr

PubChem CID 594535
CAS 1997-80-4
Molecular Weight (g/mol) 253.062
MDL Number MFCD03092900
SMILES C1=CC(=CC(=C1)C(F)(F)F)CCBr
Synonym 1-2-bromoethyl-3-trifluoromethyl benzene,3-trifluoromethyl phenethyl bromide,3-trifluoromethyl phenylethyl bromide,benzene, 1-2-bromoethyl-3-trifluoromethyl,1-bromo-2-3-trifluoromethyl phenyl ethane,acmc-20anht,3-trifluoromethylphenethyl bromide,toluene, m-2-bromoethyl-.alpha.,.alpha.,.alpha.-trifluoro,3-trifluoromethyl phenylethylbromide
IUPAC Name 1-(2-bromoethyl)-3-(trifluoromethyl)benzene
InChI Key AZLYAPKPZBXCGX-UHFFFAOYSA-N
Molecular Formula C9H8BrF3