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

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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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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4-(Trifluoromethyl)benzyl alcohol, 99%

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2-Chloro-4-(trifluoromethyl)aniline, 98%

CAS: 39885-50-2 Molecular Formula: C7H5ClF3N Molecular Weight (g/mol): 195.57 MDL Number: MFCD00042563 InChI Key: MBBUTABXEITVNY-UHFFFAOYSA-N Synonym: 2-chloro-4-trifluoromethyl aniline,4-amino-3-chlorobenzotrifluoride,4-amino-5-chloro-benzotrifluoride,benzenamine, 2-chloro-4-trifluoromethyl,3-chloro-4-aminobenzotrifluoride,2-chloro-4-trifluoromethyl-phenylamine,2-chloro-4-trifluoromethyl benzenamine,2-chloro-4-trifluoromethyl phenylamine,4-amino-3-chloro-benzotrifluoride,pubchem2474 PubChem CID: 162001 IUPAC Name: 2-chloro-4-(trifluoromethyl)aniline SMILES: NC1=CC=C(C=C1Cl)C(F)(F)F

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Specifications

PubChem CID	162001
CAS	39885-50-2
Molecular Weight (g/mol)	195.57
MDL Number	MFCD00042563
SMILES	NC1=CC=C(C=C1Cl)C(F)(F)F
Synonym	2-chloro-4-trifluoromethyl aniline,4-amino-3-chlorobenzotrifluoride,4-amino-5-chloro-benzotrifluoride,benzenamine, 2-chloro-4-trifluoromethyl,3-chloro-4-aminobenzotrifluoride,2-chloro-4-trifluoromethyl-phenylamine,2-chloro-4-trifluoromethyl benzenamine,2-chloro-4-trifluoromethyl phenylamine,4-amino-3-chloro-benzotrifluoride,pubchem2474
IUPAC Name	2-chloro-4-(trifluoromethyl)aniline
InChI Key	MBBUTABXEITVNY-UHFFFAOYSA-N
Molecular Formula	C7H5ClF3N

4-Trifluoromethyl-o-phenylenediamine, 98%

CAS: 368-71-8 Molecular Formula: C7H7F3N2 Molecular Weight (g/mol): 176.142 MDL Number: MFCD00042456 InChI Key: RQWJHUJJBYMJMN-UHFFFAOYSA-N Synonym: 3,4-diaminobenzotrifluoride,4-trifluoromethyl benzene-1,2-diamine,4-trifluoromethyl-1,2-phenylenediamine,4-trifluoromethyl-o-phenylenediamine,1,2-benzenediamine, 4-trifluoromethyl,4-trifluoromethyl-1,2-benzenediamine,3,4-diamino-benzotrifluoride,3,4-diamino benzotrifluoride PubChem CID: 520822 IUPAC Name: 4-(trifluoromethyl)benzene-1,2-diamine SMILES: C1=CC(=C(C=C1C(F)(F)F)N)N

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Specifications

PubChem CID	520822
CAS	368-71-8
Molecular Weight (g/mol)	176.142
MDL Number	MFCD00042456
SMILES	C1=CC(=C(C=C1C(F)(F)F)N)N
Synonym	3,4-diaminobenzotrifluoride,4-trifluoromethyl benzene-1,2-diamine,4-trifluoromethyl-1,2-phenylenediamine,4-trifluoromethyl-o-phenylenediamine,1,2-benzenediamine, 4-trifluoromethyl,4-trifluoromethyl-1,2-benzenediamine,3,4-diamino-benzotrifluoride,3,4-diamino benzotrifluoride
IUPAC Name	4-(trifluoromethyl)benzene-1,2-diamine
InChI Key	RQWJHUJJBYMJMN-UHFFFAOYSA-N
Molecular Formula	C7H7F3N2

4-Nitro-3-(trifluoromethyl)aniline, 98%

CAS: 393-11-3 Molecular Formula: C7H5F3N2O2 Molecular Weight (g/mol): 206.12 MDL Number: MFCD00014717 InChI Key: UTKUVRNVYFTEHF-UHFFFAOYSA-N Synonym: 4-nitro-3-trifluoromethyl aniline,5-amino-2-nitrobenzotrifluoride,3-amino-6-nitrobenzotrifluoride,benzenamine, 4-nitro-3-trifluoromethyl,3-trifluoromethyl-4-nitroaniline,2-nitro-5-amino benzotrifluoride,3-trifluoromethyl-4-nitroanilide,flu-1,3-amino-6-nitro benzotrifluoride PubChem CID: 94955 IUPAC Name: 4-nitro-3-(trifluoromethyl)aniline SMILES: NC1=CC=C(C(=C1)C(F)(F)F)[N+]([O-])=O

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Specifications

PubChem CID	94955
CAS	393-11-3
Molecular Weight (g/mol)	206.12
MDL Number	MFCD00014717
SMILES	NC1=CC=C(C(=C1)C(F)(F)F)[N+]([O-])=O
Synonym	4-nitro-3-trifluoromethyl aniline,5-amino-2-nitrobenzotrifluoride,3-amino-6-nitrobenzotrifluoride,benzenamine, 4-nitro-3-trifluoromethyl,3-trifluoromethyl-4-nitroaniline,2-nitro-5-amino benzotrifluoride,3-trifluoromethyl-4-nitroanilide,flu-1,3-amino-6-nitro benzotrifluoride
IUPAC Name	4-nitro-3-(trifluoromethyl)aniline
InChI Key	UTKUVRNVYFTEHF-UHFFFAOYSA-N
Molecular Formula	C7H5F3N2O2

2-(Trifluoromethyl)benzenesulfonyl chloride, 98%

CAS: 776-04-5 Molecular Formula: C7H4ClF3O2S Molecular Weight (g/mol): 244.612 MDL Number: MFCD00051696 InChI Key: ZIZGWNOAHUCACM-UHFFFAOYSA-N Synonym: 2-trifluoromethyl benzenesulfonyl chloride,2-trifluoromethyl benzene-1-sulfonyl chloride,2-trifluoromethylbenzenesulphonyl chloride,2-trifluoromethyl benzenesulphonyl chloride,o-trifluoromethyl benzenesulfonyl chloride,o-trifluoromethylbenzenesulfonyl chloride,2-trifluoromethyl benzene sulfonyl chloride,benzenesulfonyl chloride, 2-trifluoromethyl,alpha,alpha,alpha-trifluorotoluene-2-sulfonyl chloride PubChem CID: 136616 IUPAC Name: 2-(trifluoromethyl)benzenesulfonyl chloride SMILES: C1=CC=C(C(=C1)C(F)(F)F)S(=O)(=O)Cl

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Specifications

PubChem CID	136616
CAS	776-04-5
Molecular Weight (g/mol)	244.612
MDL Number	MFCD00051696
SMILES	C1=CC=C(C(=C1)C(F)(F)F)S(=O)(=O)Cl
Synonym	2-trifluoromethyl benzenesulfonyl chloride,2-trifluoromethyl benzene-1-sulfonyl chloride,2-trifluoromethylbenzenesulphonyl chloride,2-trifluoromethyl benzenesulphonyl chloride,o-trifluoromethyl benzenesulfonyl chloride,o-trifluoromethylbenzenesulfonyl chloride,2-trifluoromethyl benzene sulfonyl chloride,benzenesulfonyl chloride, 2-trifluoromethyl,alpha,alpha,alpha-trifluorotoluene-2-sulfonyl chloride
IUPAC Name	2-(trifluoromethyl)benzenesulfonyl chloride
InChI Key	ZIZGWNOAHUCACM-UHFFFAOYSA-N
Molecular Formula	C7H4ClF3O2S

3-Chloro-4-fluorobenzotrifluoride, 98%

CAS: 78068-85-6 Molecular Formula: C7H3ClF4 Molecular Weight (g/mol): 198.54 MDL Number: MFCD00042207 InChI Key: BKHVEYHSOXVAOP-UHFFFAOYSA-N Synonym: 3-chloro-4-fluorobenzotrifluoride,2-chloro-1-fluoro-4-trifluoromethyl benzene,benzene, 2-chloro-1-fluoro-4-trifluoromethyl,3-cholor-4-fluorobenzo-trifluoride,3-chloro-4-fluoro benzotrifluoride,1-chloro-2-fluoro-5-trifluoromethyl benzene,3-chloro-4-fluoro-1-trifluoromethyl benzene,benzene, chloro-1-fluoro-4-trifluoromethyl,3-chloro-alpha,alpha,alpha,4-tetrafluorotoluene,3-chloro-4-fluoro-alpha,alpha,alpha-trifluorotoluene PubChem CID: 157153 IUPAC Name: 2-chloro-1-fluoro-4-(trifluoromethyl)benzene SMILES: FC1=CC=C(C=C1Cl)C(F)(F)F

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Specifications

PubChem CID	157153
CAS	78068-85-6
Molecular Weight (g/mol)	198.54
MDL Number	MFCD00042207
SMILES	FC1=CC=C(C=C1Cl)C(F)(F)F
Synonym	3-chloro-4-fluorobenzotrifluoride,2-chloro-1-fluoro-4-trifluoromethyl benzene,benzene, 2-chloro-1-fluoro-4-trifluoromethyl,3-cholor-4-fluorobenzo-trifluoride,3-chloro-4-fluoro benzotrifluoride,1-chloro-2-fluoro-5-trifluoromethyl benzene,3-chloro-4-fluoro-1-trifluoromethyl benzene,benzene, chloro-1-fluoro-4-trifluoromethyl,3-chloro-alpha,alpha,alpha,4-tetrafluorotoluene,3-chloro-4-fluoro-alpha,alpha,alpha-trifluorotoluene
IUPAC Name	2-chloro-1-fluoro-4-(trifluoromethyl)benzene
InChI Key	BKHVEYHSOXVAOP-UHFFFAOYSA-N
Molecular Formula	C7H3ClF4

3-(Trifluoromethyl)benzoic acid, 98+%

CAS: 454-92-2 Molecular Formula: C8H5F3O2 Molecular Weight (g/mol): 190.12 MDL Number: MFCD00002519 InChI Key: FQXQBFUUVCDIRK-UHFFFAOYSA-N Synonym: 3-trifluoromethyl benzoic acid,m-trifluoromethylbenzoic acid,alpha,alpha,alpha-trifluoro-m-toluic acid,3-carboxybenzotrifluoride,3-trifluoromethyl-benzoic acid,benzoic acid, 3-trifluoromethyl,m-trifluoromethyl benzoic acid,3-trifluoromethyl benzoicacid,m-carboxybenzotrifluoride,a,a,a-trifluoro-m-toluic acid PubChem CID: 9963 ChEBI: CHEBI:60695 IUPAC Name: 3-(trifluoromethyl)benzoic acid SMILES: OC(=O)C1=CC=CC(=C1)C(F)(F)F

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Specifications

PubChem CID	9963
CAS	454-92-2
Molecular Weight (g/mol)	190.12
ChEBI	CHEBI:60695
MDL Number	MFCD00002519
SMILES	OC(=O)C1=CC=CC(=C1)C(F)(F)F
Synonym	3-trifluoromethyl benzoic acid,m-trifluoromethylbenzoic acid,alpha,alpha,alpha-trifluoro-m-toluic acid,3-carboxybenzotrifluoride,3-trifluoromethyl-benzoic acid,benzoic acid, 3-trifluoromethyl,m-trifluoromethyl benzoic acid,3-trifluoromethyl benzoicacid,m-carboxybenzotrifluoride,a,a,a-trifluoro-m-toluic acid
IUPAC Name	3-(trifluoromethyl)benzoic acid
InChI Key	FQXQBFUUVCDIRK-UHFFFAOYSA-N
Molecular Formula	C8H5F3O2

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)benzyl chloride, 98%

CAS: 705-29-3 Molecular Formula: C8H6ClF3 Molecular Weight (g/mol): 194.581 MDL Number: MFCD00000908 InChI Key: XGASTRVQNVVYIZ-UHFFFAOYSA-N Synonym: 3-trifluoromethyl benzyl chloride,1-chloromethyl-3-trifluoromethyl benzene,3-trifluoromethylbenzyl chloride,3-chloromethyl benzotrifluoride,m-trifluoromethylbenzyl chloride,3-chloromethyl-benzotrifluoride,benzene, 1-chloromethyl-3-trifluoromethyl,alpha'-chloro-alpha,alpha,alpha-trifluoro-m-xylene,3-chloromethylbenzotrifluoride,3-trifluoromethylbenzylchloride PubChem CID: 69716 IUPAC Name: 1-(chloromethyl)-3-(trifluoromethyl)benzene SMILES: C1=CC(=CC(=C1)C(F)(F)F)CCl

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Specifications

PubChem CID	69716
CAS	705-29-3
Molecular Weight (g/mol)	194.581
MDL Number	MFCD00000908
SMILES	C1=CC(=CC(=C1)C(F)(F)F)CCl
Synonym	3-trifluoromethyl benzyl chloride,1-chloromethyl-3-trifluoromethyl benzene,3-trifluoromethylbenzyl chloride,3-chloromethyl benzotrifluoride,m-trifluoromethylbenzyl chloride,3-chloromethyl-benzotrifluoride,benzene, 1-chloromethyl-3-trifluoromethyl,alpha'-chloro-alpha,alpha,alpha-trifluoro-m-xylene,3-chloromethylbenzotrifluoride,3-trifluoromethylbenzylchloride
IUPAC Name	1-(chloromethyl)-3-(trifluoromethyl)benzene
InChI Key	XGASTRVQNVVYIZ-UHFFFAOYSA-N
Molecular Formula	C8H6ClF3

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

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Specifications

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

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

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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

3-(Trifluoromethyl)benzonitrile, 98%

CAS: 368-77-4 Molecular Formula: C8H4F3N Molecular Weight (g/mol): 171.122 MDL Number: MFCD00001807 InChI Key: OGOBINRVCUWLGN-UHFFFAOYSA-N Synonym: 3-trifluoromethyl benzonitrile,3-cyanobenzotrifluoride,m-trifluoromethylbenzonitrile,alpha,alpha,alpha-trifluoro-m-tolunitrile,benzonitrile, 3-trifluoromethyl,a,a,a-trifluoro-m-tolunitrile,unii-y7zd7dk3ay,alpha,alpha,alpha-trifluoro-m-toluonitrile,y7zd7dk3ay,a,a,a-trifluor-m-tolunitril PubChem CID: 67783 IUPAC Name: 3-(trifluoromethyl)benzonitrile SMILES: C1=CC(=CC(=C1)C(F)(F)F)C#N

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Specifications

PubChem CID	67783
CAS	368-77-4
Molecular Weight (g/mol)	171.122
MDL Number	MFCD00001807
SMILES	C1=CC(=CC(=C1)C(F)(F)F)C#N
Synonym	3-trifluoromethyl benzonitrile,3-cyanobenzotrifluoride,m-trifluoromethylbenzonitrile,alpha,alpha,alpha-trifluoro-m-tolunitrile,benzonitrile, 3-trifluoromethyl,a,a,a-trifluoro-m-tolunitrile,unii-y7zd7dk3ay,alpha,alpha,alpha-trifluoro-m-toluonitrile,y7zd7dk3ay,a,a,a-trifluor-m-tolunitril
IUPAC Name	3-(trifluoromethyl)benzonitrile
InChI Key	OGOBINRVCUWLGN-UHFFFAOYSA-N
Molecular Formula	C8H4F3N

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

Trifluoromethylbenzenes

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