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 1,733 results

571

5-Trifluoromethyl-1,3-phenylenediamine 98.0+%, TCI America™

CAS: 368-53-6 Molecular Formula: C7H7F3N2 Molecular Weight (g/mol): 176.142 MDL Number: MFCD00014776 InChI Key: KZSXRDLXTFEHJM-UHFFFAOYSA-N Synonym: 3,5-diaminobenzotrifluoride,5-trifluoromethyl benzene-1,3-diamine,5-trifluoromethyl-1,3-phenylenediamine,5-trifluoromethyl-1,3-benzenediamine,3,5-benzotrifluorodiamine,unii-z89rd529kk,5-trifluoromethyl-benzene-1,3-diamine,1,3-benzeneamine, 5-trifluoromethyl,1,3-benzenediamine, 5-trifluoromethyl,alpha,alpha,alpha-trifluorotoluene-3,5-diamine PubChem CID: 67781 IUPAC Name: 5-(trifluoromethyl)benzene-1,3-diamine SMILES: C1=C(C=C(C=C1N)N)C(F)(F)F

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PubChem CID	67781
CAS	368-53-6
Molecular Weight (g/mol)	176.142
MDL Number	MFCD00014776
SMILES	C1=C(C=C(C=C1N)N)C(F)(F)F
Synonym	3,5-diaminobenzotrifluoride,5-trifluoromethyl benzene-1,3-diamine,5-trifluoromethyl-1,3-phenylenediamine,5-trifluoromethyl-1,3-benzenediamine,3,5-benzotrifluorodiamine,unii-z89rd529kk,5-trifluoromethyl-benzene-1,3-diamine,1,3-benzeneamine, 5-trifluoromethyl,1,3-benzenediamine, 5-trifluoromethyl,alpha,alpha,alpha-trifluorotoluene-3,5-diamine
IUPAC Name	5-(trifluoromethyl)benzene-1,3-diamine
InChI Key	KZSXRDLXTFEHJM-UHFFFAOYSA-N
Molecular Formula	C7H7F3N2

572

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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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

573

3-(Trifluoromethyl)phenylboronic Acid (contains varying amounts of Anhydride), TCI America™

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Specifications

PubChem CID	2734388
CAS	1423-26-3
MDL Number	MFCD00151854
Color	White-Yellow
Physical Form	Crystalline Powder
Chemical Name or Material	3-(Trifluoromethyl)phenylboronic Acid (contains varying amounts of Anhydride)
TSCA	No
IUPAC Name	[3-(trifluoromethyl)phenyl]boronic acid
InChI Key	WOAORAPRPVIATR-UHFFFAOYSA-N
Molecular Formula	C7H6BF3O2
Formula Weight	189.93

574

3-Hydroxybenzotrifluoride 98.0+%, TCI America™

CAS: 98-17-9 Molecular Formula: C7H5F3O Molecular Weight (g/mol): 162.111 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

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PubChem CID	7376
CAS	98-17-9
Molecular Weight (g/mol)	162.111
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

575

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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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

576

4-(Trifluoromethyl)benzoyl Chloride 97.0+%, TCI America™

CAS: 329-15-7 Molecular Formula: C8H4ClF3O Molecular Weight (g/mol): 208.56 MDL Number: MFCD00000694 InChI Key: OXZYBOLWRXENKT-UHFFFAOYSA-N Synonym: 4-trifluoromethyl benzoyl chloride,p-trifluoromethyl benzoyl chloride,p-trifluoromethylbenzoyl chloride,benzoyl chloride, 4-trifluoromethyl,alpha,alpha,alpha-trifluoro-p-toluoyl chloride,4-trifluoromethyl benzoylchloride,p-trifluoromethyl benzoic acid chloride,ptf-boc,4-trifluoromethylbenzoylchloride,4-trifluoromethyl-benzoyl chloride PubChem CID: 67607 IUPAC Name: 4-(trifluoromethyl)benzoyl chloride SMILES: FC(F)(F)C1=CC=C(C=C1)C(Cl)=O

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PubChem CID	67607
CAS	329-15-7
Molecular Weight (g/mol)	208.56
MDL Number	MFCD00000694
SMILES	FC(F)(F)C1=CC=C(C=C1)C(Cl)=O
Synonym	4-trifluoromethyl benzoyl chloride,p-trifluoromethyl benzoyl chloride,p-trifluoromethylbenzoyl chloride,benzoyl chloride, 4-trifluoromethyl,alpha,alpha,alpha-trifluoro-p-toluoyl chloride,4-trifluoromethyl benzoylchloride,p-trifluoromethyl benzoic acid chloride,ptf-boc,4-trifluoromethylbenzoylchloride,4-trifluoromethyl-benzoyl chloride
IUPAC Name	4-(trifluoromethyl)benzoyl chloride
InChI Key	OXZYBOLWRXENKT-UHFFFAOYSA-N
Molecular Formula	C8H4ClF3O

577

3-(Trifluoromethyl)benzoic Acid 98.0+%, TCI America™

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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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

578

2-(3-Trifluoromethylphenyl)ethylamine 96.0+%, TCI America™

CAS: 52516-30-0 Molecular Formula: C9H10F3N Molecular Weight (g/mol): 189.181 MDL Number: MFCD00040756 InChI Key: BPVYCXMGJPKOTQ-UHFFFAOYSA-N Synonym: 2-3-trifluoromethyl phenyl ethanamine,3-trifluoromethyl phenethylamine,2-3-trifluoromethylphenyl ethylamine,2-3-trifluoromethyl phenyl ethylamine,phenethylamine, m-trifluoromethyl,m-trifluoromethylphenethylamine,m-trifluoromethyl phenethylamine,benzeneethanamine, 3-trifluoromethyl,2-3-trifluoromethylphenyl-ethylamine PubChem CID: 104223 IUPAC Name: 2-[3-(trifluoromethyl)phenyl]ethanamine SMILES: C1=CC(=CC(=C1)C(F)(F)F)CCN

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PubChem CID	104223
CAS	52516-30-0
Molecular Weight (g/mol)	189.181
MDL Number	MFCD00040756
SMILES	C1=CC(=CC(=C1)C(F)(F)F)CCN
Synonym	2-3-trifluoromethyl phenyl ethanamine,3-trifluoromethyl phenethylamine,2-3-trifluoromethylphenyl ethylamine,2-3-trifluoromethyl phenyl ethylamine,phenethylamine, m-trifluoromethyl,m-trifluoromethylphenethylamine,m-trifluoromethyl phenethylamine,benzeneethanamine, 3-trifluoromethyl,2-3-trifluoromethylphenyl-ethylamine
IUPAC Name	2-[3-(trifluoromethyl)phenyl]ethanamine
InChI Key	BPVYCXMGJPKOTQ-UHFFFAOYSA-N
Molecular Formula	C9H10F3N

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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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

2-(4-Trifluoromethylphenyl)ethylamine 98.0+%, TCI America™

CAS: 775-00-8 Molecular Formula: C9H10F3N Molecular Weight (g/mol): 189.181 MDL Number: MFCD01529875 InChI Key: HMFOBPNVAAAACP-UHFFFAOYSA-N Synonym: 4-trifluoromethylphenethylamine,2-4-trifluoromethyl-phenyl-ethylamine,2-4-trifluoromethyl phenyl ethanamine,4-trifluoromethyl phenethylamine,2-4-trifluoromethyl-phenyl ethylamine,2-4-trifluoromethylphenyl ethylamine,2-4-trifluoromethyl phenyl ethan-1-amine,2-4-trifluoromethyl phenyl ethylamine,2-4-trifluoromethyl phenyl ethyl amine PubChem CID: 1988106 IUPAC Name: 2-[4-(trifluoromethyl)phenyl]ethanamine SMILES: C1=CC(=CC=C1CCN)C(F)(F)F

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PubChem CID	1988106
CAS	775-00-8
Molecular Weight (g/mol)	189.181
MDL Number	MFCD01529875
SMILES	C1=CC(=CC=C1CCN)C(F)(F)F
Synonym	4-trifluoromethylphenethylamine,2-4-trifluoromethyl-phenyl-ethylamine,2-4-trifluoromethyl phenyl ethanamine,4-trifluoromethyl phenethylamine,2-4-trifluoromethyl-phenyl ethylamine,2-4-trifluoromethylphenyl ethylamine,2-4-trifluoromethyl phenyl ethan-1-amine,2-4-trifluoromethyl phenyl ethylamine,2-4-trifluoromethyl phenyl ethyl amine
IUPAC Name	2-[4-(trifluoromethyl)phenyl]ethanamine
InChI Key	HMFOBPNVAAAACP-UHFFFAOYSA-N
Molecular Formula	C9H10F3N

581

2-(Trifluoromethyl)phenyl Isothiocyanate 98.0+%, TCI America™

CAS: 1743-86-8 Molecular Formula: C8H4F3NS Molecular Weight (g/mol): 203.182 MDL Number: MFCD00039644 InChI Key: FCEKLQPJGXIQRY-UHFFFAOYSA-N Synonym: 2-trifluoromethyl phenyl isothiocyanate,1-isothiocyanato-2-trifluoromethyl benzene,2-trifluoromethylphenylisothiocyanate,2-trifluoromethyl phenylisothiocyanate,2-trifluoromethylphenyl isothiocyanate,o-trifluoromethyl phenyl isothiocyanate,1-isothiocyanato-2-trifluoromethyl-benzene,benzene, 1-isothiocyanato-2-trifluoromethyl,alpha,alpha,alpha-trifluoro-o-tolyl isothiocyanate,isothiocyanic acid 2-trifluoromethyl phenyl ester PubChem CID: 737162 IUPAC Name: 1-isothiocyanato-2-(trifluoromethyl)benzene SMILES: C1=CC=C(C(=C1)C(F)(F)F)N=C=S

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Specifications

PubChem CID	737162
CAS	1743-86-8
Molecular Weight (g/mol)	203.182
MDL Number	MFCD00039644
SMILES	C1=CC=C(C(=C1)C(F)(F)F)N=C=S
Synonym	2-trifluoromethyl phenyl isothiocyanate,1-isothiocyanato-2-trifluoromethyl benzene,2-trifluoromethylphenylisothiocyanate,2-trifluoromethyl phenylisothiocyanate,2-trifluoromethylphenyl isothiocyanate,o-trifluoromethyl phenyl isothiocyanate,1-isothiocyanato-2-trifluoromethyl-benzene,benzene, 1-isothiocyanato-2-trifluoromethyl,alpha,alpha,alpha-trifluoro-o-tolyl isothiocyanate,isothiocyanic acid 2-trifluoromethyl phenyl ester
IUPAC Name	1-isothiocyanato-2-(trifluoromethyl)benzene
InChI Key	FCEKLQPJGXIQRY-UHFFFAOYSA-N
Molecular Formula	C8H4F3NS

582

3-(Trifluoromethyl)benzyl Bromide 98.0+%, TCI America™

CAS: 402-23-3 Molecular Formula: C8H6BrF3 Molecular Weight (g/mol): 239.04 MDL Number: MFCD00000395 InChI Key: MYYYZNVAUZVXBO-UHFFFAOYSA-N Synonym: 3-trifluoromethyl benzyl bromide,1-bromomethyl-3-trifluoromethyl benzene,m-trifluoromethylbenzyl bromide,3-trifluoromethylbenzyl bromide,3-bromomethyl benzotrifluoride,3-trifluoromethylbenzylbromide,3-trifluoromethyl benzylbromide,1-bromomethyl-3-trifluoromethyl-benzene,alpha'-bromo-alpha,alpha,alpha-trifluoro-m-xylene PubChem CID: 123061 IUPAC Name: 1-(bromomethyl)-3-(trifluoromethyl)benzene SMILES: FC(F)(F)C1=CC=CC(CBr)=C1

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Specifications

PubChem CID	123061
CAS	402-23-3
Molecular Weight (g/mol)	239.04
MDL Number	MFCD00000395
SMILES	FC(F)(F)C1=CC=CC(CBr)=C1
Synonym	3-trifluoromethyl benzyl bromide,1-bromomethyl-3-trifluoromethyl benzene,m-trifluoromethylbenzyl bromide,3-trifluoromethylbenzyl bromide,3-bromomethyl benzotrifluoride,3-trifluoromethylbenzylbromide,3-trifluoromethyl benzylbromide,1-bromomethyl-3-trifluoromethyl-benzene,alpha'-bromo-alpha,alpha,alpha-trifluoro-m-xylene
IUPAC Name	1-(bromomethyl)-3-(trifluoromethyl)benzene
InChI Key	MYYYZNVAUZVXBO-UHFFFAOYSA-N
Molecular Formula	C8H6BrF3

583

Sigma Aldrich diisopropyl succinate

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.

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CAS	924-88-9

584

Boiling Point	136°C to 138°C (lit.)
Linear Formula	ClC6H4CF3
Molecular Weight (g/mol)	180.55
Density	1.353 g/mL (at 25°C (literature))
Percent Purity	98%
CAS	98-56-6
MDL Number	MFCD00000627
Refractive Index	n20/D 1.446 (literature)
Synonym	1-Chloro-4-(trifluoromethyl)benzene; 4-Chloro-alpha,alpha,alpha-trifluorotoluene
RTECS Number	XS9145000
Recommended Storage	Room Temperature
Molecular Formula	C7H4ClF3
EINECS Number	202-681-1
Melting Point	-36°C (lit.)

585

Sigma Aldrich 1,3-Dimethyl-2,6-dioxo-1,2,3,6-tetrahydropyrimidine-4-carboxylic acid

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CAS	4116-38-5

Trifluoromethylbenzenes

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