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.

1 – 15 of 533 results

TraceCERT™ 2,4-Dichlorobenzotrifluoride, Certified Reference Material, MilliporeSigma™ Supelco™

This certified reference material (CRM) is produced and certified in accordance with ISO/IEC 17025 and ISO 17034. This CRM is traceable to the SI through a primary reference material from a NMI. Certified content incl. uncertainty and expiry date are stated on the enclosed certificate.

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Bicalutamide Impurity D, British Pharmacopoeia (BP) Reference Standard, MilliporeSigma™ Supelco™

This product is provided as delivered and specified by the issuing Pharmacopoeia. All information provided in support of this product, including SDS and any product information leaflets, has been developed and issued under the Authority of the issuing Pharmacopoeia.

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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

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Specifications

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

3,5-Bis(trifluoromethyl)benzonitrile, 97%

CAS: 27126-93-8 Molecular Formula: C9H3F6N Molecular Weight (g/mol): 239.12 MDL Number: MFCD00000379 InChI Key: CZKHHAOIHXHOSR-UHFFFAOYSA-N Synonym: 3,5-bis trifluoromethyl benzonitrile,3,5-di trifluoromethyl benzonitrile,bis 3,5-trifluoromethyl benzonitrile,mbt-cn,3,5-bis-trifluoromethyl benzonitrile,benzonitrile, 3,5-bis trifluoromethyl,3,5-bis trifluoromethyl benzenecarbonitrile,fxffr ccn exfff,pubchem4691,3,5-bis tifluoromethyl-1-cyanobenzene PubChem CID: 96746 IUPAC Name: 3,5-bis(trifluoromethyl)benzonitrile SMILES: FC(F)(F)C1=CC(=CC(=C1)C#N)C(F)(F)F

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Specifications

PubChem CID	96746
CAS	27126-93-8
Molecular Weight (g/mol)	239.12
MDL Number	MFCD00000379
SMILES	FC(F)(F)C1=CC(=CC(=C1)C#N)C(F)(F)F
Synonym	3,5-bis trifluoromethyl benzonitrile,3,5-di trifluoromethyl benzonitrile,bis 3,5-trifluoromethyl benzonitrile,mbt-cn,3,5-bis-trifluoromethyl benzonitrile,benzonitrile, 3,5-bis trifluoromethyl,3,5-bis trifluoromethyl benzenecarbonitrile,fxffr ccn exfff,pubchem4691,3,5-bis tifluoromethyl-1-cyanobenzene
IUPAC Name	3,5-bis(trifluoromethyl)benzonitrile
InChI Key	CZKHHAOIHXHOSR-UHFFFAOYSA-N
Molecular Formula	C9H3F6N

3-(Trifluoromethyl)benzyl alcohol, 97%

CAS: 349-75-7 Molecular Formula: C8H7F3O Molecular Weight (g/mol): 176.138 MDL Number: MFCD00004645 InChI Key: BXEHKCUWIODEDE-UHFFFAOYSA-N Synonym: 3-trifluoromethyl benzyl alcohol,3-trifluoromethylbenzyl alcohol,3-trifluoromethyl phenyl methanol,3-trifluoromethyl benzylalcohol,m-trifluoromethylbenzyl alcohol,m-trifluoromethyl benzyl alcohol,3-trifluoromethyl benzylic alcohol,benzenemethanol, 3-trifluoromethyl,m-trifluorome benzyl alcohol PubChem CID: 67681 IUPAC Name: [3-(trifluoromethyl)phenyl]methanol SMILES: C1=CC(=CC(=C1)C(F)(F)F)CO

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Specifications

PubChem CID	67681
CAS	349-75-7
Molecular Weight (g/mol)	176.138
MDL Number	MFCD00004645
SMILES	C1=CC(=CC(=C1)C(F)(F)F)CO
Synonym	3-trifluoromethyl benzyl alcohol,3-trifluoromethylbenzyl alcohol,3-trifluoromethyl phenyl methanol,3-trifluoromethyl benzylalcohol,m-trifluoromethylbenzyl alcohol,m-trifluoromethyl benzyl alcohol,3-trifluoromethyl benzylic alcohol,benzenemethanol, 3-trifluoromethyl,m-trifluorome benzyl alcohol
IUPAC Name	[3-(trifluoromethyl)phenyl]methanol
InChI Key	BXEHKCUWIODEDE-UHFFFAOYSA-N
Molecular Formula	C8H7F3O

3-(Trifluoromethyl)aniline, 99%

CAS: 98-16-8 Molecular Formula: C7H6F3N Molecular Weight (g/mol): 161.127 MDL Number: MFCD00007797 InChI Key: VIUDTWATMPPKEL-UHFFFAOYSA-N Synonym: 3-trifluoromethyl aniline,3-aminobenzotrifluoride,m-aminobenzotrifluoride,3-aminotrifluorotoluene,benzenamine, 3-trifluoromethyl,3-trifluoromethyl benzenamine,m-abtf,m-trifluoromethylaniline,m-amino trifluorotoluene,m-trifluoromethyl aniline PubChem CID: 7375 IUPAC Name: 3-(trifluoromethyl)aniline SMILES: C1=CC(=CC(=C1)N)C(F)(F)F

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Specifications

PubChem CID	7375
CAS	98-16-8
Molecular Weight (g/mol)	161.127
MDL Number	MFCD00007797
SMILES	C1=CC(=CC(=C1)N)C(F)(F)F
Synonym	3-trifluoromethyl aniline,3-aminobenzotrifluoride,m-aminobenzotrifluoride,3-aminotrifluorotoluene,benzenamine, 3-trifluoromethyl,3-trifluoromethyl benzenamine,m-abtf,m-trifluoromethylaniline,m-amino trifluorotoluene,m-trifluoromethyl aniline
IUPAC Name	3-(trifluoromethyl)aniline
InChI Key	VIUDTWATMPPKEL-UHFFFAOYSA-N
Molecular Formula	C7H6F3N

4-Bromobenzotrifluoride, 99%

CAS: 402-43-7 Molecular Formula: C7H4BrF3 Molecular Weight (g/mol): 225.008 MDL Number: MFCD00000398 InChI Key: XLQSXGGDTHANLN-UHFFFAOYSA-N Synonym: 4-bromobenzotrifluoride,1-bromo-4-trifluoromethyl benzene,benzene, 1-bromo-4-trifluoromethyl,p-bromobenzotrifluoride,4-bromotrifluorotoluene,4-bromo-alpha,alpha,alpha-trifluorotoluene,p-bromotrifluoromethylbenzene,4-trifluoromethyl bromobenzene,4-bromo-a,a,a-trifluorotoluene,4-trifluoromethylbromobenzene PubChem CID: 67872 IUPAC Name: 1-bromo-4-(trifluoromethyl)benzene SMILES: C1=CC(=CC=C1C(F)(F)F)Br

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Specifications

PubChem CID	67872
CAS	402-43-7
Molecular Weight (g/mol)	225.008
MDL Number	MFCD00000398
SMILES	C1=CC(=CC=C1C(F)(F)F)Br
Synonym	4-bromobenzotrifluoride,1-bromo-4-trifluoromethyl benzene,benzene, 1-bromo-4-trifluoromethyl,p-bromobenzotrifluoride,4-bromotrifluorotoluene,4-bromo-alpha,alpha,alpha-trifluorotoluene,p-bromotrifluoromethylbenzene,4-trifluoromethyl bromobenzene,4-bromo-a,a,a-trifluorotoluene,4-trifluoromethylbromobenzene
IUPAC Name	1-bromo-4-(trifluoromethyl)benzene
InChI Key	XLQSXGGDTHANLN-UHFFFAOYSA-N
Molecular Formula	C7H4BrF3

2-Chloro-5-(trifluoromethyl)aniline, 97%

CAS: 121-50-6 Molecular Formula: C7H5ClF3N Molecular Weight (g/mol): 195.569 MDL Number: MFCD00007673 InChI Key: VKTTYIXIDXWHKW-UHFFFAOYSA-N Synonym: 3-amino-4-chlorobenzotrifluoride,2-chloro-5-trifluoromethyl aniline,fast orange rd oil,fast orange salt rd,orange salt nrd,benzenamine, 2-chloro-5-trifluoromethyl,fast orange rd salt,daito orange salt rd,diazo fast orange rd,fast orange salt rda PubChem CID: 8475 IUPAC Name: 2-chloro-5-(trifluoromethyl)aniline SMILES: C1=CC(=C(C=C1C(F)(F)F)N)Cl

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Specifications

PubChem CID	8475
CAS	121-50-6
Molecular Weight (g/mol)	195.569
MDL Number	MFCD00007673
SMILES	C1=CC(=C(C=C1C(F)(F)F)N)Cl
Synonym	3-amino-4-chlorobenzotrifluoride,2-chloro-5-trifluoromethyl aniline,fast orange rd oil,fast orange salt rd,orange salt nrd,benzenamine, 2-chloro-5-trifluoromethyl,fast orange rd salt,daito orange salt rd,diazo fast orange rd,fast orange salt rda
IUPAC Name	2-chloro-5-(trifluoromethyl)aniline
InChI Key	VKTTYIXIDXWHKW-UHFFFAOYSA-N
Molecular Formula	C7H5ClF3N

4-(Trifluoromethyl)benzonitrile, 98%

CAS: 455-18-5 Molecular Formula: C8H4F3N Molecular Weight (g/mol): 171.122 MDL Number: MFCD00001826 InChI Key: DRNJIKRLQJRKMM-UHFFFAOYSA-N Synonym: 4-trifluoromethyl benzonitrile,benzonitrile, 4-trifluoromethyl,alpha,alpha,alpha-trifluoro-p-tolunitrile,4-cyanobenzotrifluoride,p-trifluoromethylbenzonitrile,p-trifluoromethyl benzonitrile,benzonitrile, p-trifluoromethyl,p-trifluoromethylbenonitrile,para-trifluoromethyl-benzonitrile,p-cyanobenzotrifluoride PubChem CID: 67995 IUPAC Name: 4-(trifluoromethyl)benzonitrile SMILES: C1=CC(=CC=C1C#N)C(F)(F)F

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Specifications

PubChem CID	67995
CAS	455-18-5
Molecular Weight (g/mol)	171.122
MDL Number	MFCD00001826
SMILES	C1=CC(=CC=C1C#N)C(F)(F)F
Synonym	4-trifluoromethyl benzonitrile,benzonitrile, 4-trifluoromethyl,alpha,alpha,alpha-trifluoro-p-tolunitrile,4-cyanobenzotrifluoride,p-trifluoromethylbenzonitrile,p-trifluoromethyl benzonitrile,benzonitrile, p-trifluoromethyl,p-trifluoromethylbenonitrile,para-trifluoromethyl-benzonitrile,p-cyanobenzotrifluoride
IUPAC Name	4-(trifluoromethyl)benzonitrile
InChI Key	DRNJIKRLQJRKMM-UHFFFAOYSA-N
Molecular Formula	C8H4F3N

3-(Trifluoromethyl)benzoyl chloride, 97%

CAS: 2251-65-2 Molecular Formula: C8H4ClF3O Molecular Weight (g/mol): 208.564 MDL Number: MFCD00000680 InChI Key: RUJYJCANMOTJMO-UHFFFAOYSA-N Synonym: 3-trifluoromethyl benzoyl chloride,benzoyl chloride, 3-trifluoromethyl,m-trifluoromethyl benzoyl chloride,m-trifluoromethylbenzoyl chloride,alpha,alpha,alpha-trifluoro-m-toluoyl chloride,3-trifluoromethyl benzoylchloride,3-trifluoromethyl-benzoyl chloride,alpha,alpha,alpha-trifluoro-m-tolyl chloride,pubchem5468 PubChem CID: 75257 IUPAC Name: 3-(trifluoromethyl)benzoyl chloride SMILES: C1=CC(=CC(=C1)C(F)(F)F)C(=O)Cl

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Specifications

PubChem CID	75257
CAS	2251-65-2
Molecular Weight (g/mol)	208.564
MDL Number	MFCD00000680
SMILES	C1=CC(=CC(=C1)C(F)(F)F)C(=O)Cl
Synonym	3-trifluoromethyl benzoyl chloride,benzoyl chloride, 3-trifluoromethyl,m-trifluoromethyl benzoyl chloride,m-trifluoromethylbenzoyl chloride,alpha,alpha,alpha-trifluoro-m-toluoyl chloride,3-trifluoromethyl benzoylchloride,3-trifluoromethyl-benzoyl chloride,alpha,alpha,alpha-trifluoro-m-tolyl chloride,pubchem5468
IUPAC Name	3-(trifluoromethyl)benzoyl chloride
InChI Key	RUJYJCANMOTJMO-UHFFFAOYSA-N
Molecular Formula	C8H4ClF3O

2-Iodobenzotrifluoride, 99%

CAS: 444-29-1 Molecular Formula: C7H4F3I Molecular Weight (g/mol): 272.009 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

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Specifications

PubChem CID	67957
CAS	444-29-1
Molecular Weight (g/mol)	272.009
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

5-Bromo-2-nitrobenzotrifluoride, 98+%

CAS: 344-38-7 Molecular Formula: C7H3BrF3NO2 Molecular Weight (g/mol): 270.005 MDL Number: MFCD00014706 InChI Key: ZHLYHEDQTJZYFI-UHFFFAOYSA-N Synonym: 5-bromo-2-nitrobenzotrifluoride,4-bromo-1-nitro-2-trifluoromethyl benzene,2-nitro-5-bromobenzotrifluoride,5-bromo-2-nitro-a,a,a-trifluorotoluene,5-bromo-a-a,a-trifluoro-2-nitrotoluene,4-bromo-1-nitro-2 trifluoromethyl benzene,4-bromo-1-nitro-2-trifluoromethyl-benzene,benzene, 4-bromo-1-nitro-2-trifluoromethyl,5-bromo-alpha,alpha,alpha-trifluoro-2-nitrotoluene,2-nitro-5-bromotrifluorotoluol PubChem CID: 136171 IUPAC Name: 4-bromo-1-nitro-2-(trifluoromethyl)benzene SMILES: C1=CC(=C(C=C1Br)C(F)(F)F)[N+](=O)[O-]

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Specifications

PubChem CID	136171
CAS	344-38-7
Molecular Weight (g/mol)	270.005
MDL Number	MFCD00014706
SMILES	C1=CC(=C(C=C1Br)C(F)(F)F)[N+](=O)[O-]
Synonym	5-bromo-2-nitrobenzotrifluoride,4-bromo-1-nitro-2-trifluoromethyl benzene,2-nitro-5-bromobenzotrifluoride,5-bromo-2-nitro-a,a,a-trifluorotoluene,5-bromo-a-a,a-trifluoro-2-nitrotoluene,4-bromo-1-nitro-2 trifluoromethyl benzene,4-bromo-1-nitro-2-trifluoromethyl-benzene,benzene, 4-bromo-1-nitro-2-trifluoromethyl,5-bromo-alpha,alpha,alpha-trifluoro-2-nitrotoluene,2-nitro-5-bromotrifluorotoluol
IUPAC Name	4-bromo-1-nitro-2-(trifluoromethyl)benzene
InChI Key	ZHLYHEDQTJZYFI-UHFFFAOYSA-N
Molecular Formula	C7H3BrF3NO2

2-Fluorobenzotrifluoride, 99%

CAS: 392-85-8 Molecular Formula: C7H4F4 Molecular Weight (g/mol): 164.103 MDL Number: MFCD00000374 InChI Key: BGVGHYOIWIALFF-UHFFFAOYSA-N Synonym: 2-fluorobenzotrifluoride,1-fluoro-2-trifluoromethyl benzene,o-fluorobenzotrifluoride,benzene, 1-fluoro-2-trifluoromethyl,alpha,alpha,alpha,2-tetrafluorotoluene,benzene, fluoro trifluoromethyl,o,alpha,alpha,alpha-tetrafluorotoluene,a,a,a,2-tetrafluorotoluene,alpha,alpha,alpha,ar-tetrafluorotoluene,2-trifluoromethyl fluorobenzene PubChem CID: 9807 IUPAC Name: 1-fluoro-2-(trifluoromethyl)benzene SMILES: C1=CC=C(C(=C1)C(F)(F)F)F

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Specifications

PubChem CID	9807
CAS	392-85-8
Molecular Weight (g/mol)	164.103
MDL Number	MFCD00000374
SMILES	C1=CC=C(C(=C1)C(F)(F)F)F
Synonym	2-fluorobenzotrifluoride,1-fluoro-2-trifluoromethyl benzene,o-fluorobenzotrifluoride,benzene, 1-fluoro-2-trifluoromethyl,alpha,alpha,alpha,2-tetrafluorotoluene,benzene, fluoro trifluoromethyl,o,alpha,alpha,alpha-tetrafluorotoluene,a,a,a,2-tetrafluorotoluene,alpha,alpha,alpha,ar-tetrafluorotoluene,2-trifluoromethyl fluorobenzene
IUPAC Name	1-fluoro-2-(trifluoromethyl)benzene
InChI Key	BGVGHYOIWIALFF-UHFFFAOYSA-N
Molecular Formula	C7H4F4

2-Fluoro-5-nitrobenzotrifluoride, 98%

CAS: 400-74-8 Molecular Formula: C7H3F4NO2 Molecular Weight (g/mol): 209.1 MDL Number: MFCD00024576 InChI Key: DNTHMWUMRGOJRY-UHFFFAOYSA-N Synonym: 2-fluoro-5-nitrobenzotrifluoride,1-fluoro-4-nitro-2-trifluoromethyl benzene,benzene, 1-fluoro-4-nitro-2-trifluoromethyl,alpha,alpha,alpha-2-tetrafluorotoluene,2-fluoro-5-nitro trifluoromethyl benzene,1-fluoro-4-nitro-2-trifluoromethyl-benzene,1-fluoro-2-trifluoromethyl-4-nitrobenzene,5-nitro-alpha,alpha,alpha,2-tetrafluorotoluene,pubchem1653,2-fluor-5-nitrobenzotrifluorid PubChem CID: 94954 IUPAC Name: 1-fluoro-4-nitro-2-(trifluoromethyl)benzene SMILES: C1=CC(=C(C=C1[N+](=O)[O-])C(F)(F)F)F

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Specifications

PubChem CID	94954
CAS	400-74-8
Molecular Weight (g/mol)	209.1
MDL Number	MFCD00024576
SMILES	C1=CC(=C(C=C1[N+](=O)[O-])C(F)(F)F)F
Synonym	2-fluoro-5-nitrobenzotrifluoride,1-fluoro-4-nitro-2-trifluoromethyl benzene,benzene, 1-fluoro-4-nitro-2-trifluoromethyl,alpha,alpha,alpha-2-tetrafluorotoluene,2-fluoro-5-nitro trifluoromethyl benzene,1-fluoro-4-nitro-2-trifluoromethyl-benzene,1-fluoro-2-trifluoromethyl-4-nitrobenzene,5-nitro-alpha,alpha,alpha,2-tetrafluorotoluene,pubchem1653,2-fluor-5-nitrobenzotrifluorid
IUPAC Name	1-fluoro-4-nitro-2-(trifluoromethyl)benzene
InChI Key	DNTHMWUMRGOJRY-UHFFFAOYSA-N
Molecular Formula	C7H3F4NO2

4-(Trifluoromethyl)benzyl bromide, 98%

CAS: 402-49-3 Molecular Formula: C8H6BrF3 Molecular Weight (g/mol): 239.035 MDL Number: MFCD00000403 InChI Key: IKSNDOVDVVPSMA-UHFFFAOYSA-N Synonym: 4-trifluoromethyl benzyl bromide,1-bromomethyl-4-trifluoromethyl benzene,4-trifluoromethylbenzyl bromide,4-bromomethyl benzotrifluoride,p-trifluoromethylbenzyl bromide,4-trifluoromethyl benzylbromide,benzene, 1-bromomethyl-4-trifluoromethyl,4-trifluoromethylbenzylbromide,p-trifluoromethyl benzyl bromide,alpha'-bromo-alpha,alpha,alpha-trifluoro-p-xylene PubChem CID: 123062 IUPAC Name: 1-(bromomethyl)-4-(trifluoromethyl)benzene SMILES: C1=CC(=CC=C1CBr)C(F)(F)F

Pricing and Availability
Specifications

PubChem CID	123062
CAS	402-49-3
Molecular Weight (g/mol)	239.035
MDL Number	MFCD00000403
SMILES	C1=CC(=CC=C1CBr)C(F)(F)F
Synonym	4-trifluoromethyl benzyl bromide,1-bromomethyl-4-trifluoromethyl benzene,4-trifluoromethylbenzyl bromide,4-bromomethyl benzotrifluoride,p-trifluoromethylbenzyl bromide,4-trifluoromethyl benzylbromide,benzene, 1-bromomethyl-4-trifluoromethyl,4-trifluoromethylbenzylbromide,p-trifluoromethyl benzyl bromide,alpha'-bromo-alpha,alpha,alpha-trifluoro-p-xylene
IUPAC Name	1-(bromomethyl)-4-(trifluoromethyl)benzene
InChI Key	IKSNDOVDVVPSMA-UHFFFAOYSA-N
Molecular Formula	C8H6BrF3

Trifluoromethylbenzenes

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