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-Bromo-3,5-bis(trifluoromethyl)benzene, 98%

CAS: 328-70-1 Formula molecolare: C8H3BrF6 Molecular Weight (g/mol): 293.006 Numero MDL: MFCD00000381 InChI Key: CSVCVIHEBDJTCJ-UHFFFAOYSA-N Sinonimo: 3,5-bis trifluoromethyl bromobenzene,1-bromo-3,5-bis trifluoromethyl benzene,1,3-bis trifluoromethyl-5-bromobenzene,mbt-br,3,5-di trifluoromethyl bromobenzene,3,5-bis trifluoromethyl-1-bromobenzene,3,5-bis-trifluoromethylbromobenzene,benzene, 1-bromo-3,5-bis trifluoromethyl,3,5-bis trifluoromethyl phenyl bromide,1-bromo-3,5-bis-trifluoromethyl-benzene PubChem CID: 67602 IUPAC Name: 1-bromo-3,5-bis(trifluoromethyl)benzene SMILES: C1=C(C=C(C=C1C(F)(F)F)Br)C(F)(F)F

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Sinonimo	3,5-bis trifluoromethyl bromobenzene,1-bromo-3,5-bis trifluoromethyl benzene,1,3-bis trifluoromethyl-5-bromobenzene,mbt-br,3,5-di trifluoromethyl bromobenzene,3,5-bis trifluoromethyl-1-bromobenzene,3,5-bis-trifluoromethylbromobenzene,benzene, 1-bromo-3,5-bis trifluoromethyl,3,5-bis trifluoromethyl phenyl bromide,1-bromo-3,5-bis-trifluoromethyl-benzene
Numero MDL	MFCD00000381
PubChem CID	67602
Formula molecolare	C8H3BrF6
CAS	328-70-1
Molecular Weight (g/mol)	293.006
SMILES	C1=C(C=C(C=C1C(F)(F)F)Br)C(F)(F)F
IUPAC Name	1-bromo-3,5-bis(trifluoromethyl)benzene
InChI Key	CSVCVIHEBDJTCJ-UHFFFAOYSA-N

Benzotrifluoride, 99%

CAS: 98-08-8 Formula molecolare: C7H5F3 Molecular Weight (g/mol): 146.112 Numero MDL: MFCD00000372 InChI Key: GETTZEONDQJALK-UHFFFAOYSA-N Sinonimo: benzotrifluoride,trifluoromethyl benzene,alpha,alpha,alpha-trifluorotoluene,phenylfluoroform,benzene, trifluoromethyl,benzenyl fluoride,benzylidyne fluoride,usaf ma-16,a,a,a-trifluorotoluene,trifluoro toluene PubChem CID: 7368 ChEBI: CHEBI:36810 IUPAC Name: trifluoromethylbenzene SMILES: C1=CC=C(C=C1)C(F)(F)F

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Sinonimo	benzotrifluoride,trifluoromethyl benzene,alpha,alpha,alpha-trifluorotoluene,phenylfluoroform,benzene, trifluoromethyl,benzenyl fluoride,benzylidyne fluoride,usaf ma-16,a,a,a-trifluorotoluene,trifluoro toluene
Numero MDL	MFCD00000372
PubChem CID	7368
Formula molecolare	C7H5F3
CAS	98-08-8
Molecular Weight (g/mol)	146.112
ChEBI	CHEBI:36810
SMILES	C1=CC=C(C=C1)C(F)(F)F
IUPAC Name	trifluoromethylbenzene
InChI Key	GETTZEONDQJALK-UHFFFAOYSA-N

4-(Trifluoromethyl)benzaldehyde, 98%

CAS: 455-19-6 Formula molecolare: C₈H₅F₃O Molecular Weight (g/mol): 174.12 Numero MDL: MFCD00006952 InChI Key: BEOBZEOPTQQELP-UHFFFAOYSA-N Sinonimo: 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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Sinonimo	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
Numero MDL	MFCD00006952
PubChem CID	67996
Formula molecolare	C₈H₅F₃O
CAS	455-19-6
Molecular Weight (g/mol)	174.12
SMILES	C1=CC(=CC=C1C=O)C(F)(F)F
IUPAC Name	4-(trifluoromethyl)benzaldehyde
InChI Key	BEOBZEOPTQQELP-UHFFFAOYSA-N

alpha,alpha,alpha-Trifluorotoluene, 99+%

CAS: 98-08-8 Formula molecolare: C₇H₅F₃ Molecular Weight (g/mol): 146.11 Numero MDL: MFCD00000372 InChI Key: GETTZEONDQJALK-UHFFFAOYSA-N Sinonimo: benzotrifluoride,trifluoromethyl benzene,alpha,alpha,alpha-trifluorotoluene,phenylfluoroform,benzene, trifluoromethyl,benzenyl fluoride,benzylidyne fluoride,usaf ma-16,a,a,a-trifluorotoluene,trifluoro toluene PubChem CID: 7368 ChEBI: CHEBI:36810 IUPAC Name: trifluoromethylbenzene SMILES: C1=CC=C(C=C1)C(F)(F)F

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Sinonimo	benzotrifluoride,trifluoromethyl benzene,alpha,alpha,alpha-trifluorotoluene,phenylfluoroform,benzene, trifluoromethyl,benzenyl fluoride,benzylidyne fluoride,usaf ma-16,a,a,a-trifluorotoluene,trifluoro toluene
Numero MDL	MFCD00000372
PubChem CID	7368
Formula molecolare	C₇H₅F₃
CAS	98-08-8
Molecular Weight (g/mol)	146.11
ChEBI	CHEBI:36810
SMILES	C1=CC=C(C=C1)C(F)(F)F
IUPAC Name	trifluoromethylbenzene
InChI Key	GETTZEONDQJALK-UHFFFAOYSA-N

4-Chlorobenzotrifluoride, 98%

CAS: 98-56-6 Formula molecolare: C₇H₄ClF₃ Molecular Weight (g/mol): 180.56 Numero MDL: MFCD00000627 InChI Key: QULYNCCPRWKEMF-UHFFFAOYSA-N Sinonimo: 4-chlorobenzotrifluoride,p-chlorobenzotrifluoride,1-chloro-4-trifluoromethyl benzene,benzene, 1-chloro-4-trifluoromethyl,4-chloro-alpha,alpha,alpha-trifluorotoluene,para-chlorobenzotrifluoride,p-chlorophenyl trifluoromethane,p-chloro-a,a,a-trifluorotoluene,pcbtf,p-chlorotrifluoromethylbenzene PubChem CID: 7394 IUPAC Name: 1-chloro-4-(trifluoromethyl)benzene SMILES: C1=CC(=CC=C1C(F)(F)F)Cl

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Sinonimo	4-chlorobenzotrifluoride,p-chlorobenzotrifluoride,1-chloro-4-trifluoromethyl benzene,benzene, 1-chloro-4-trifluoromethyl,4-chloro-alpha,alpha,alpha-trifluorotoluene,para-chlorobenzotrifluoride,p-chlorophenyl trifluoromethane,p-chloro-a,a,a-trifluorotoluene,pcbtf,p-chlorotrifluoromethylbenzene
Numero MDL	MFCD00000627
PubChem CID	7394
Formula molecolare	C₇H₄ClF₃
CAS	98-56-6
Molecular Weight (g/mol)	180.56
SMILES	C1=CC(=CC=C1C(F)(F)F)Cl
IUPAC Name	1-chloro-4-(trifluoromethyl)benzene
InChI Key	QULYNCCPRWKEMF-UHFFFAOYSA-N

3-(Trifluoromethyl)aniline, 99%

CAS: 98-16-8 Formula molecolare: C7H6F3N Molecular Weight (g/mol): 161.127 Numero MDL: MFCD00007797 InChI Key: VIUDTWATMPPKEL-UHFFFAOYSA-N Sinonimo: 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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Sinonimo	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
Numero MDL	MFCD00007797
PubChem CID	7375
Formula molecolare	C7H6F3N
CAS	98-16-8
Molecular Weight (g/mol)	161.127
SMILES	C1=CC(=CC(=C1)N)C(F)(F)F
IUPAC Name	3-(trifluoromethyl)aniline
InChI Key	VIUDTWATMPPKEL-UHFFFAOYSA-N

4-Trifluoromethylbenzoic anhydride, 97%

CAS: 25753-16-6 Formula molecolare: C16H8F6O3 Molecular Weight (g/mol): 362.227 Numero MDL: MFCD00671577 InChI Key: FNAWJOBKLWLHTA-UHFFFAOYSA-N Sinonimo: 4-trifluoromethyl benzoic anhydride,tfba,4-trifluoromethylbenzoic anhydride,4-trifluoromethyl benzoyl 4-trifluoromethyl benzoate,benzoic acid,4-trifluoromethyl-, anhydride with 4-trifluoromethyl benzoic acid,acmc-1cg53,p-trifluoromethylbenzoic acid anhydride,bis 4-trifluoromethylbenzoic acid anhydride,benzoic acid, 4-trifluoromethyl-, anhydride PubChem CID: 2760733 IUPAC Name: [4-(trifluoromethyl)benzoyl] 4-(trifluoromethyl)benzoate SMILES: C1=CC(=CC=C1C(=O)OC(=O)C2=CC=C(C=C2)C(F)(F)F)C(F)(F)F

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Sinonimo	4-trifluoromethyl benzoic anhydride,tfba,4-trifluoromethylbenzoic anhydride,4-trifluoromethyl benzoyl 4-trifluoromethyl benzoate,benzoic acid,4-trifluoromethyl-, anhydride with 4-trifluoromethyl benzoic acid,acmc-1cg53,p-trifluoromethylbenzoic acid anhydride,bis 4-trifluoromethylbenzoic acid anhydride,benzoic acid, 4-trifluoromethyl-, anhydride
Numero MDL	MFCD00671577
PubChem CID	2760733
Formula molecolare	C16H8F6O3
CAS	25753-16-6
Molecular Weight (g/mol)	362.227
SMILES	C1=CC(=CC=C1C(=O)OC(=O)C2=CC=C(C=C2)C(F)(F)F)C(F)(F)F
IUPAC Name	[4-(trifluoromethyl)benzoyl] 4-(trifluoromethyl)benzoate
InChI Key	FNAWJOBKLWLHTA-UHFFFAOYSA-N

4-(Trifluoromethyl)benzyl alcohol, 98%

CAS: 349-95-1 Formula molecolare: C8H7F3O Molecular Weight (g/mol): 176.138 Numero MDL: MFCD00004661 InChI Key: MOOUWXDQAUXZRG-UHFFFAOYSA-N Sinonimo: 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

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Sinonimo	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
Numero MDL	MFCD00004661
PubChem CID	67684
Formula molecolare	C8H7F3O
CAS	349-95-1
Molecular Weight (g/mol)	176.138
SMILES	C1=CC(=CC=C1CO)C(F)(F)F
IUPAC Name	[4-(trifluoromethyl)phenyl]methanol
InChI Key	MOOUWXDQAUXZRG-UHFFFAOYSA-N

3,5-Bis(trifluoromethyl)phenylmagnesium bromide, 0.5M solution in THF, AcroSeal™

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4-(Trifluoromethyl)phenol, 98%

CAS: 402-45-9 Formula molecolare: C₇H₅F₃O Molecular Weight (g/mol): 162.11 Numero MDL: MFCD00002363 InChI Key: BAYGVMXZJBFEMB-UHFFFAOYSA-N Sinonimo: 4-trifluoromethyl phenol,4-hydroxybenzotrifluoride,alpha,alpha,alpha-trifluoro-p-cresol,p-trifluoromethylphenol,p-hydroxybenzotrifluoride,phenol, 4-trifluoromethyl,a,a,a-trifluoro-p-cresol,4-trifluoromethyl-phenol,para-trifluoromethylphenol PubChem CID: 67874 ChEBI: CHEBI:42578 IUPAC Name: 4-(trifluoromethyl)phenol SMILES: C1=CC(=CC=C1C(F)(F)F)O

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Sinonimo	4-trifluoromethyl phenol,4-hydroxybenzotrifluoride,alpha,alpha,alpha-trifluoro-p-cresol,p-trifluoromethylphenol,p-hydroxybenzotrifluoride,phenol, 4-trifluoromethyl,a,a,a-trifluoro-p-cresol,4-trifluoromethyl-phenol,para-trifluoromethylphenol
Numero MDL	MFCD00002363
PubChem CID	67874
Formula molecolare	C₇H₅F₃O
CAS	402-45-9
Molecular Weight (g/mol)	162.11
ChEBI	CHEBI:42578
SMILES	C1=CC(=CC=C1C(F)(F)F)O
IUPAC Name	4-(trifluoromethyl)phenol
InChI Key	BAYGVMXZJBFEMB-UHFFFAOYSA-N

Methyl 3-(trifluoromethyl)phenylacetate, 97%, Thermo Scientific™

CAS: 62451-84-7 Formula molecolare: C₁₀H₉F₃O₂ Molecular Weight (g/mol): 218.17 Numero MDL: MFCD04039762 InChI Key: GMEBDKGPPKAPEM-UHFFFAOYSA-N PubChem CID: 2734603 IUPAC Name: methyl 2-[3-(trifluoromethyl)phenyl]acetate SMILES: COC(=O)CC1=CC(=CC=C1)C(F)(F)F

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Numero MDL	MFCD04039762
PubChem CID	2734603
Formula molecolare	C₁₀H₉F₃O₂
CAS	62451-84-7
Molecular Weight (g/mol)	218.17
SMILES	COC(=O)CC1=CC(=CC=C1)C(F)(F)F
IUPAC Name	methyl 2-[3-(trifluoromethyl)phenyl]acetate
InChI Key	GMEBDKGPPKAPEM-UHFFFAOYSA-N

2-(Trifluoromethyl)phenylhydrazine, 97%

CAS: 365-34-4 Formula molecolare: C7H7F3N2 Molecular Weight (g/mol): 176.142 Numero MDL: MFCD00052687 InChI Key: JSWQDLBFVSTSIW-UHFFFAOYSA-N Sinonimo: 2-trifluoromethyl phenylhydrazine,2-trifluoromethyl phenyl hydrazine,2-trifluoromethylphenylhydrazine,1-2-trifluoromethyl phenyl hydrazine,m-trifluoromethylphenylhydrazine,hydrazine, 2-trifluoromethyl phenyl,buttpark 44\57-17,2-trifluoromethyl-phenyl-hydrazine PubChem CID: 520800 IUPAC Name: [2-(trifluoromethyl)phenyl]hydrazine SMILES: C1=CC=C(C(=C1)C(F)(F)F)NN

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Sinonimo	2-trifluoromethyl phenylhydrazine,2-trifluoromethyl phenyl hydrazine,2-trifluoromethylphenylhydrazine,1-2-trifluoromethyl phenyl hydrazine,m-trifluoromethylphenylhydrazine,hydrazine, 2-trifluoromethyl phenyl,buttpark 44\57-17,2-trifluoromethyl-phenyl-hydrazine
Numero MDL	MFCD00052687
PubChem CID	520800
Formula molecolare	C7H7F3N2
CAS	365-34-4
Molecular Weight (g/mol)	176.142
SMILES	C1=CC=C(C(=C1)C(F)(F)F)NN
IUPAC Name	[2-(trifluoromethyl)phenyl]hydrazine
InChI Key	JSWQDLBFVSTSIW-UHFFFAOYSA-N

3-Fluoro-5-(trifluoromethyl)phenyl isocyanate, Thermo Scientific™

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4-Fluoro-2-(trifluoromethyl)phenol, 95%, Thermo Scientific Chemicals

CAS: 130047-19-7 Formula molecolare: C7H4F4O Molecular Weight (g/mol): 180.10 Numero MDL: MFCD00061290 InChI Key: RNOVGJWJVRESAA-UHFFFAOYSA-N Sinonimo: 4-fluoro-2-trifluoromethyl phenol,2-trifluoromethyl-4-fluorophenol,5-fluoro-2-hydroxybenzotrifluoride,pubchem4146,acmc-1bxww,intermediates-zcf02005,ksc495m8f,4-fluoro-2-trifluoromethyl,4-fluoro-2-trifluoromethyl-phenol PubChem CID: 518675 IUPAC Name: 4-fluoro-2-(trifluoromethyl)phenol SMILES: OC1=C(C=C(F)C=C1)C(F)(F)F

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Sinonimo	4-fluoro-2-trifluoromethyl phenol,2-trifluoromethyl-4-fluorophenol,5-fluoro-2-hydroxybenzotrifluoride,pubchem4146,acmc-1bxww,intermediates-zcf02005,ksc495m8f,4-fluoro-2-trifluoromethyl,4-fluoro-2-trifluoromethyl-phenol
Numero MDL	MFCD00061290
PubChem CID	518675
Formula molecolare	C7H4F4O
CAS	130047-19-7
Molecular Weight (g/mol)	180.10
SMILES	OC1=C(C=C(F)C=C1)C(F)(F)F
IUPAC Name	4-fluoro-2-(trifluoromethyl)phenol
InChI Key	RNOVGJWJVRESAA-UHFFFAOYSA-N

3-Methoxy-5-(trifluoromethyl)phenylboronic acid, 97%

CAS: 871332-97-7 Formula molecolare: C8H8BF3O3 Molecular Weight (g/mol): 219.95 Numero MDL: MFCD08056362 InChI Key: GKEMDZIGTOAZRK-UHFFFAOYSA-N Sinonimo: 3-methoxy-5-trifluoromethyl phenylboronic acid,3-methoxy-5-trifluoromethyl benzeneboronic acid,3-methoxy-5-trifluoromethyl phenyl boronic acid,5-methoxy-3-trifluoromethylbenzeneboronic acid,3-methoxy-5-trifluoromethyl benzeneboronicacid,3-methoxy-5-trifluoromethylphenylboronic acid,boronic acid, 3-methoxy-5-trifluoromethyl phenyl,acmc-209qhq PubChem CID: 44717590 IUPAC Name: [3-methoxy-5-(trifluoromethyl)phenyl]boronic acid SMILES: COC1=CC(=CC(=C1)C(F)(F)F)B(O)O

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Sinonimo	3-methoxy-5-trifluoromethyl phenylboronic acid,3-methoxy-5-trifluoromethyl benzeneboronic acid,3-methoxy-5-trifluoromethyl phenyl boronic acid,5-methoxy-3-trifluoromethylbenzeneboronic acid,3-methoxy-5-trifluoromethyl benzeneboronicacid,3-methoxy-5-trifluoromethylphenylboronic acid,boronic acid, 3-methoxy-5-trifluoromethyl phenyl,acmc-209qhq
Numero MDL	MFCD08056362
PubChem CID	44717590
Formula molecolare	C8H8BF3O3
CAS	871332-97-7
Molecular Weight (g/mol)	219.95
SMILES	COC1=CC(=CC(=C1)C(F)(F)F)B(O)O
IUPAC Name	[3-methoxy-5-(trifluoromethyl)phenyl]boronic acid
InChI Key	GKEMDZIGTOAZRK-UHFFFAOYSA-N

Trifluoromethylbenzenes

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