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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571 – 585 of 1,561 results

571

2-(Trifluoromethyl)benzaldehyde 97.0+%, TCI America™

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

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Specifications

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

572

2-(Trifluoromethyl)-1,4-phenylenediamine 98.0+%, TCI America™

CAS: 364-13-6 Molecular Formula: C7H7F3N2 Molecular Weight (g/mol): 176.142 MDL Number: MFCD00036101 InChI Key: ZQQOGBKIFPCFMJ-UHFFFAOYSA-N Synonym: 2,5-Diaminobenzotrifluoride PubChem CID: 136197 IUPAC Name: 2-(trifluoromethyl)benzene-1,4-diamine SMILES: C1=CC(=C(C=C1N)C(F)(F)F)N

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Specifications

PubChem CID	136197
CAS	364-13-6
Molecular Weight (g/mol)	176.142
MDL Number	MFCD00036101
SMILES	C1=CC(=C(C=C1N)C(F)(F)F)N
Synonym	2,5-Diaminobenzotrifluoride
IUPAC Name	2-(trifluoromethyl)benzene-1,4-diamine
InChI Key	ZQQOGBKIFPCFMJ-UHFFFAOYSA-N
Molecular Formula	C7H7F3N2

573

2-(3-Trifluoromethylanilino)nicotinic Acid 98.0+%, TCI America™

CAS: 4394-00-7 Molecular Formula: C13H9F3N2O2 Molecular Weight (g/mol): 282.22 MDL Number: MFCD00010569 InChI Key: JZFPYUNJRRFVQU-UHFFFAOYSA-N Synonym: niflumic acid,nifluril,landruma,forenol,actol,acido niflumico,nifluminic acid,acide niflumique,acidum niflumicum,acide niflumique inn-french PubChem CID: 4488 ChEBI: CHEBI:34888 IUPAC Name: 2-{[3-(trifluoromethyl)phenyl]amino}pyridine-3-carboxylic acid SMILES: OC(=O)C1=CC=CN=C1NC1=CC=CC(=C1)C(F)(F)F

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Specifications

PubChem CID	4488
CAS	4394-00-7
Molecular Weight (g/mol)	282.22
ChEBI	CHEBI:34888
MDL Number	MFCD00010569
SMILES	OC(=O)C1=CC=CN=C1NC1=CC=CC(=C1)C(F)(F)F
Synonym	niflumic acid,nifluril,landruma,forenol,actol,acido niflumico,nifluminic acid,acide niflumique,acidum niflumicum,acide niflumique inn-french
IUPAC Name	2-{[3-(trifluoromethyl)phenyl]amino}pyridine-3-carboxylic acid
InChI Key	JZFPYUNJRRFVQU-UHFFFAOYSA-N
Molecular Formula	C13H9F3N2O2

574

4-(Trifluoromethyl)phenyl Isocyanate 98.0+%, TCI America™

CAS: 1548-13-6 Molecular Formula: C8H4F3NO Molecular Weight (g/mol): 187.12 MDL Number: MFCD00002028 InChI Key: QZTWVDCKDWZCLV-UHFFFAOYSA-N Synonym: 4-trifluoromethyl phenyl isocyanate,1-isocyanato-4-trifluoromethyl benzene,alpha,alpha,alpha-trifluoro-p-tolyl isocyanate,4-trifluoromethyl phenylisocyanate,4-isocyanatobenzotrifluoride,4-trifluoromethylphenyl isocyanate,benzene, 1-isocyanato-4-trifluoromethyl,p-trifluoromethylphenyl isocyanate,isocyanic acid 4-trifluoromethyl phenyl ester,4-trifluoromethyl benzenisocyanate PubChem CID: 73768 IUPAC Name: 1-isocyanato-4-(trifluoromethyl)benzene SMILES: FC(F)(F)C1=CC=C(C=C1)N=C=O

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Specifications

PubChem CID	73768
CAS	1548-13-6
Molecular Weight (g/mol)	187.12
MDL Number	MFCD00002028
SMILES	FC(F)(F)C1=CC=C(C=C1)N=C=O
Synonym	4-trifluoromethyl phenyl isocyanate,1-isocyanato-4-trifluoromethyl benzene,alpha,alpha,alpha-trifluoro-p-tolyl isocyanate,4-trifluoromethyl phenylisocyanate,4-isocyanatobenzotrifluoride,4-trifluoromethylphenyl isocyanate,benzene, 1-isocyanato-4-trifluoromethyl,p-trifluoromethylphenyl isocyanate,isocyanic acid 4-trifluoromethyl phenyl ester,4-trifluoromethyl benzenisocyanate
IUPAC Name	1-isocyanato-4-(trifluoromethyl)benzene
InChI Key	QZTWVDCKDWZCLV-UHFFFAOYSA-N
Molecular Formula	C8H4F3NO

575

4-Bromobenzotrifluoride 98.0+%, TCI America™

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

576

3-Bromo-4-fluorobenzotrifluoride 96.0+%, TCI America™

CAS: 68322-84-9 Molecular Formula: C7H3BrF4 Molecular Weight (g/mol): 243.00 MDL Number: MFCD00040938 InChI Key: RZJOIMPUMMQKFR-UHFFFAOYSA-N Synonym: 3-bromo-4-fluorobenzotrifluoride,2-bromo-1-fluoro-4-trifluoromethyl benzene,2-fluoro-5-trifluoromethyl bromobenzene,3-bromo-alpha,alpha,alpha,4-tetrafluorotoluene,benzene, 2-bromo-1-fluoro-4-trifluoromethyl,1-bromo-2-fluoro-5-trifluoromethyl benzene,3-bromo-alpha,alpha,alpha-4-tetrafluorotoluene,pubchem1639,3-bromo-4-fluoro trifluoromethyl benzene PubChem CID: 144295 IUPAC Name: 2-bromo-1-fluoro-4-(trifluoromethyl)benzene SMILES: FC1=CC=C(C=C1Br)C(F)(F)F

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Specifications

PubChem CID	144295
CAS	68322-84-9
Molecular Weight (g/mol)	243.00
MDL Number	MFCD00040938
SMILES	FC1=CC=C(C=C1Br)C(F)(F)F
Synonym	3-bromo-4-fluorobenzotrifluoride,2-bromo-1-fluoro-4-trifluoromethyl benzene,2-fluoro-5-trifluoromethyl bromobenzene,3-bromo-alpha,alpha,alpha,4-tetrafluorotoluene,benzene, 2-bromo-1-fluoro-4-trifluoromethyl,1-bromo-2-fluoro-5-trifluoromethyl benzene,3-bromo-alpha,alpha,alpha-4-tetrafluorotoluene,pubchem1639,3-bromo-4-fluoro trifluoromethyl benzene
IUPAC Name	2-bromo-1-fluoro-4-(trifluoromethyl)benzene
InChI Key	RZJOIMPUMMQKFR-UHFFFAOYSA-N
Molecular Formula	C7H3BrF4

577

3,5-Bis(trifluoromethyl)phenylboronic Acid (contains varying amounts of Anhydride), TCI America™

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Specifications

Molecular Weight (g/mol)	257.926
Color	White-Yellow
Physical Form	Crystalline Powder
SMILES	B(C1=CC(=CC(=C1)C(F)(F)F)C(F)(F)F)(O)O
InChI Key	BPTABBGLHGBJQR-UHFFFAOYSA-N
PubChem CID	156265
CAS	73852-19-4
MDL Number	MFCD00051850
Synonym	3,5-bis trifluoromethyl phenylboronic acid,3,5-bis trifluoromethyl benzeneboronic acid,3,5-bis trifluoromethyl phenyl boronic acid,3,5-bis-trifluoromethylphenylboronic acid,3,5-bis trifluoromethylphenyl boronic acid
TSCA	No
IUPAC Name	[3,5-bis(trifluoromethyl)phenyl]boronic acid
Molecular Formula	C8H5BF6O2
Formula Weight	257.93
Melting Point	220°C

578

4-(Trifluoromethyl)benzenesulfonyl Chloride 98.0+%, TCI America™

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)benzene-1-sulfonyl chloride SMILES: FC(F)(F)C1=CC=C(C=C1)S(Cl)(=O)=O

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Specifications

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)benzene-1-sulfonyl chloride
InChI Key	OZDCZHDOIBUGAJ-UHFFFAOYSA-N
Molecular Formula	C7H4ClF3O2S

579

4-(Trifluoromethyl)phenylacetic Acid 97.0+%, TCI America™

CAS: 32857-62-8 Molecular Formula: C9H7F3O2 Molecular Weight (g/mol): 204.15 MDL Number: MFCD00004352 InChI Key: HNORVZDAANCHAY-UHFFFAOYSA-N Synonym: 4-trifluoromethyl phenylacetic acid,2-4-trifluoromethyl phenyl acetic acid,4-trifluoromethylphenylacetic acid,4-trifluoromethyl phenyl acetic acid,alpha,alpha,alpha-trifluoro-p-tolyl acetic acid,benzeneacetic acid, 4-trifluoromethyl,p-trifluoromethyl phenylacetic acid,p-trifluoromethylphenylacetic acid,alpha,alpha,alpha-trifluoro-4-tolyl acetic acid PubChem CID: 118342 IUPAC Name: 2-[4-(trifluoromethyl)phenyl]acetic acid SMILES: OC(=O)CC1=CC=C(C=C1)C(F)(F)F

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Specifications

PubChem CID	118342
CAS	32857-62-8
Molecular Weight (g/mol)	204.15
MDL Number	MFCD00004352
SMILES	OC(=O)CC1=CC=C(C=C1)C(F)(F)F
Synonym	4-trifluoromethyl phenylacetic acid,2-4-trifluoromethyl phenyl acetic acid,4-trifluoromethylphenylacetic acid,4-trifluoromethyl phenyl acetic acid,alpha,alpha,alpha-trifluoro-p-tolyl acetic acid,benzeneacetic acid, 4-trifluoromethyl,p-trifluoromethyl phenylacetic acid,p-trifluoromethylphenylacetic acid,alpha,alpha,alpha-trifluoro-4-tolyl acetic acid
IUPAC Name	2-[4-(trifluoromethyl)phenyl]acetic acid
InChI Key	HNORVZDAANCHAY-UHFFFAOYSA-N
Molecular Formula	C9H7F3O2

580

3,5-Bis(trifluoromethyl)phenylboronic Acid (contains varying amounts of Anhydride), TCI America™

CAS: 73852-19-4 Molecular Formula: C8H5BF6O2 Molecular Weight (g/mol): 257.93 MDL Number: MFCD00051850 InChI Key: BPTABBGLHGBJQR-UHFFFAOYSA-N Synonym: 3,5-bis trifluoromethyl phenylboronic acid,3,5-bis trifluoromethyl benzeneboronic acid,3,5-bis trifluoromethyl phenyl boronic acid,3,5-bis-trifluoromethylphenylboronic acid,3,5-bis trifluoromethylphenyl boronic acid,3,5-bis trifluoromethyl phenylboroic acid,btfpba,3,5-bis trifluoromethyl phenyl boranediol PubChem CID: 156265 IUPAC Name: [3,5-bis(trifluoromethyl)phenyl]boronic acid SMILES: OB(O)C1=CC(=CC(=C1)C(F)(F)F)C(F)(F)F

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Specifications

PubChem CID	156265
CAS	73852-19-4
Molecular Weight (g/mol)	257.93
MDL Number	MFCD00051850
SMILES	OB(O)C1=CC(=CC(=C1)C(F)(F)F)C(F)(F)F
Synonym	3,5-bis trifluoromethyl phenylboronic acid,3,5-bis trifluoromethyl benzeneboronic acid,3,5-bis trifluoromethyl phenyl boronic acid,3,5-bis-trifluoromethylphenylboronic acid,3,5-bis trifluoromethylphenyl boronic acid,3,5-bis trifluoromethyl phenylboroic acid,btfpba,3,5-bis trifluoromethyl phenyl boranediol
IUPAC Name	[3,5-bis(trifluoromethyl)phenyl]boronic acid
InChI Key	BPTABBGLHGBJQR-UHFFFAOYSA-N
Molecular Formula	C8H5BF6O2

581

2-Iodobenzotrifluoride (stabilized with Copper chip) 98.0+%, TCI America™

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

582

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

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 IUPAC Name: 1-[4-(trifluoromethyl)phenyl]methanamine SMILES: NCC1=CC=C(C=C1)C(F)(F)F

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Specifications

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
IUPAC Name	1-[4-(trifluoromethyl)phenyl]methanamine
InChI Key	PRDBLLIPPDOICK-UHFFFAOYSA-N
Molecular Formula	C8H8F3N

583

Sigma Aldrich 5-(Trifluoromethyl)-1,3-phenylenediamine

MilliporeSigma Sigma Organics products encompass a wide range of quality reagents, solvents, catalysts, and building blocks for organic synthesis. From benchtop discovery to process development and scale-up, Sigma Organics solutions are built to meet the needs of synthetic chemists.