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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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Keyword Search:
1 – 15 of 32 results
1

2,5-Bis(trifluoromethyl)benzoic acid, 98%

CAS: 42580-42-7 Molecular Formula: C9H4F6O2 Molecular Weight (g/mol): 258.119 MDL Number: MFCD00013249 InChI Key: PINBPLCVZSKLTF-UHFFFAOYSA-N PubChem CID: 736187 ChEBI: CHEBI:60697 IUPAC Name: 2,5-bis(trifluoromethyl)benzoic acid SMILES: C1=CC(=C(C=C1C(F)(F)F)C(=O)O)C(F)(F)F

PubChem CID 736187
CAS 42580-42-7
Molecular Weight (g/mol) 258.119
ChEBI CHEBI:60697
MDL Number MFCD00013249
SMILES C1=CC(=C(C=C1C(F)(F)F)C(=O)O)C(F)(F)F
IUPAC Name 2,5-bis(trifluoromethyl)benzoic acid
InChI Key PINBPLCVZSKLTF-UHFFFAOYSA-N
Molecular Formula C9H4F6O2
2

2-Fluoro-3-(trifluoromethyl)benzoic acid, 98%

CAS: 115029-22-6 Molecular Formula: C8H3F4O2 Molecular Weight (g/mol): 207.10 MDL Number: MFCD00040980 InChI Key: XVEAMDNSCPPPCP-UHFFFAOYSA-M Synonym: 2-fluoro-3-trifluoromethyl benzoic acid,2-fluoro-3-trifluoromethyl benzoicacid,alpha,alpha,alpha,2-tetrafluoro-m-toluic acid,2-fluoro-3-trifluoromethyl-benzoic acid,benzoic acid, 2-fluoro-3-trifluoromethyl,2-fluoro-3-trifluoromethylbenzioc acid,pubchem2741,acmc-1boz3,ksc489q1l,rarechem al bo 0625 PubChem CID: 518002 IUPAC Name: 2-fluoro-3-(trifluoromethyl)benzoic acid SMILES: [O-]C(=O)C1=CC=CC(=C1F)C(F)(F)F

PubChem CID 518002
CAS 115029-22-6
Molecular Weight (g/mol) 207.10
MDL Number MFCD00040980
SMILES [O-]C(=O)C1=CC=CC(=C1F)C(F)(F)F
Synonym 2-fluoro-3-trifluoromethyl benzoic acid,2-fluoro-3-trifluoromethyl benzoicacid,alpha,alpha,alpha,2-tetrafluoro-m-toluic acid,2-fluoro-3-trifluoromethyl-benzoic acid,benzoic acid, 2-fluoro-3-trifluoromethyl,2-fluoro-3-trifluoromethylbenzioc acid,pubchem2741,acmc-1boz3,ksc489q1l,rarechem al bo 0625
IUPAC Name 2-fluoro-3-(trifluoromethyl)benzoic acid
InChI Key XVEAMDNSCPPPCP-UHFFFAOYSA-M
Molecular Formula C8H3F4O2
3

2,6-Bis(trifluoromethyl)benzoic acid, 98%

CAS: 24821-22-5 Molecular Formula: C9H4F6O2 Molecular Weight (g/mol): 258.119 MDL Number: MFCD00000376 InChI Key: XZNLSDPNMNWCRE-UHFFFAOYSA-N Synonym: 2,6-bis trifluoromethyl benzoic acid,benzoic acid, 2,6-bis trifluoromethyl,2,6-bis-trifluoromethylbenzoic acid,2,6-di trifluoromethyl benzoic acid,2,6-bis-trifluoromethyl-benzoic acid,2,6-bis trifluoromethyl-benzoic acid,pubchem4988,acmc-1co7v,rarechem al bo 0513,timtec-bb sbb000962 PubChem CID: 90618 IUPAC Name: 2,6-bis(trifluoromethyl)benzoic acid SMILES: C1=CC(=C(C(=C1)C(F)(F)F)C(=O)O)C(F)(F)F

PubChem CID 90618
CAS 24821-22-5
Molecular Weight (g/mol) 258.119
MDL Number MFCD00000376
SMILES C1=CC(=C(C(=C1)C(F)(F)F)C(=O)O)C(F)(F)F
Synonym 2,6-bis trifluoromethyl benzoic acid,benzoic acid, 2,6-bis trifluoromethyl,2,6-bis-trifluoromethylbenzoic acid,2,6-di trifluoromethyl benzoic acid,2,6-bis-trifluoromethyl-benzoic acid,2,6-bis trifluoromethyl-benzoic acid,pubchem4988,acmc-1co7v,rarechem al bo 0513,timtec-bb sbb000962
IUPAC Name 2,6-bis(trifluoromethyl)benzoic acid
InChI Key XZNLSDPNMNWCRE-UHFFFAOYSA-N
Molecular Formula C9H4F6O2
4

2,6-Bis(trifluoromethyl)benzoic acid, 98%

CAS: 24821-22-5 Molecular Formula: C9H4F6O2 Molecular Weight (g/mol): 258.11 InChI Key: XZNLSDPNMNWCRE-UHFFFAOYSA-N Synonym: 2,6-bis trifluoromethyl benzoic acid,benzoic acid, 2,6-bis trifluoromethyl,2,6-bis-trifluoromethylbenzoic acid,2,6-di trifluoromethyl benzoic acid,2,6-bis-trifluoromethyl-benzoic acid,2,6-bis trifluoromethyl-benzoic acid,pubchem4988,acmc-1co7v,rarechem al bo 0513,timtec-bb sbb000962 PubChem CID: 90618 IUPAC Name: 2,6-bis(trifluoromethyl)benzoic acid SMILES: C1=CC(=C(C(=C1)C(F)(F)F)C(=O)O)C(F)(F)F

PubChem CID 90618
CAS 24821-22-5
Molecular Weight (g/mol) 258.11
SMILES C1=CC(=C(C(=C1)C(F)(F)F)C(=O)O)C(F)(F)F
Synonym 2,6-bis trifluoromethyl benzoic acid,benzoic acid, 2,6-bis trifluoromethyl,2,6-bis-trifluoromethylbenzoic acid,2,6-di trifluoromethyl benzoic acid,2,6-bis-trifluoromethyl-benzoic acid,2,6-bis trifluoromethyl-benzoic acid,pubchem4988,acmc-1co7v,rarechem al bo 0513,timtec-bb sbb000962
IUPAC Name 2,6-bis(trifluoromethyl)benzoic acid
InChI Key XZNLSDPNMNWCRE-UHFFFAOYSA-N
Molecular Formula C9H4F6O2
7

2-Chloro-3-(trifluoromethyl)benzoic acid, 97+%, Thermo Scientific™

CAS: 39226-97-6 Molecular Formula: C8H4ClF3O2 Molecular Weight (g/mol): 224.563 MDL Number: MFCD00792415 InChI Key: AXOAWWUSRZCGKS-UHFFFAOYSA-N Synonym: 2-chloro-3-trifluoromethyl benzoic acid,2-chloro-3-trifluoromethyl-benzoic acid,benzoic acid, 2-chloro-3-trifluoromethyl,2-chloro-3-trifluoromethyl benzoicacid,acmc-1ahj6,ksc496e0b,rarechem al be 0475,rarechem al be 0520,rarechem al bo 0356 PubChem CID: 2736677 IUPAC Name: 2-chloro-3-(trifluoromethyl)benzoic acid SMILES: C1=CC(=C(C(=C1)C(F)(F)F)Cl)C(=O)O

PubChem CID 2736677
CAS 39226-97-6
Molecular Weight (g/mol) 224.563
MDL Number MFCD00792415
SMILES C1=CC(=C(C(=C1)C(F)(F)F)Cl)C(=O)O
Synonym 2-chloro-3-trifluoromethyl benzoic acid,2-chloro-3-trifluoromethyl-benzoic acid,benzoic acid, 2-chloro-3-trifluoromethyl,2-chloro-3-trifluoromethyl benzoicacid,acmc-1ahj6,ksc496e0b,rarechem al be 0475,rarechem al be 0520,rarechem al bo 0356
IUPAC Name 2-chloro-3-(trifluoromethyl)benzoic acid
InChI Key AXOAWWUSRZCGKS-UHFFFAOYSA-N
Molecular Formula C8H4ClF3O2
8

2-Chloro-3-(trifluoromethyl)benzyl alcohol, 97+%, Thermo Scientific™

CAS: 261763-20-6 Molecular Formula: C8H6ClF3O Molecular Weight (g/mol): 210.58 MDL Number: MFCD01631537 InChI Key: MQUXXVLMXCHGDZ-UHFFFAOYSA-N Synonym: 2-chloro-3-trifluoromethyl benzyl alcohol,2-chloro-3-trifluoromethyl phenyl methanol,2-chloro-3-trifluoromethyl benzylalcohol,2-chloro-3-trifluoromethyl phenyl methan-1-ol,acmc-1coey,rarechem al bd 0475,rarechem al bd 1301,2-chloro-3-trifluoromethyl-benzylalcohol,2-chloro-3-trifluoromethylbenzyl alcohol PubChem CID: 2778108 IUPAC Name: [2-chloro-3-(trifluoromethyl)phenyl]methanol SMILES: C1=CC(=C(C(=C1)C(F)(F)F)Cl)CO

PubChem CID 2778108
CAS 261763-20-6
Molecular Weight (g/mol) 210.58
MDL Number MFCD01631537
SMILES C1=CC(=C(C(=C1)C(F)(F)F)Cl)CO
Synonym 2-chloro-3-trifluoromethyl benzyl alcohol,2-chloro-3-trifluoromethyl phenyl methanol,2-chloro-3-trifluoromethyl benzylalcohol,2-chloro-3-trifluoromethyl phenyl methan-1-ol,acmc-1coey,rarechem al bd 0475,rarechem al bd 1301,2-chloro-3-trifluoromethyl-benzylalcohol,2-chloro-3-trifluoromethylbenzyl alcohol
IUPAC Name [2-chloro-3-(trifluoromethyl)phenyl]methanol
InChI Key MQUXXVLMXCHGDZ-UHFFFAOYSA-N
Molecular Formula C8H6ClF3O
9

3-Fluoro-5-(trifluoromethyl)benzoic acid, 98%, Thermo Scientific™

CAS: 161622-05-5 Molecular Formula: C8H3F4O2 Molecular Weight (g/mol): 207.10 MDL Number: MFCD00061293 InChI Key: NSGKIIGVPBTOBF-UHFFFAOYSA-M Synonym: 3-fluoro-5-trifluoromethyl benzoic acid,alpha,alpha,alpha,5-tetrafluoro-m-toluic acid,benzoic acid, 3-fluoro-5-trifluoromethyl,5-fluoro-3-trifluoromethyl benzoic acid,maybridge4_001933,acmc-1bwlq,intermediates-zcf02214,ksc496a7r,rarechem al bo 0634,buttpark 32\01-71 PubChem CID: 519222 IUPAC Name: 3-fluoro-5-(trifluoromethyl)benzoic acid SMILES: [O-]C(=O)C1=CC(F)=CC(=C1)C(F)(F)F

PubChem CID 519222
CAS 161622-05-5
Molecular Weight (g/mol) 207.10
MDL Number MFCD00061293
SMILES [O-]C(=O)C1=CC(F)=CC(=C1)C(F)(F)F
Synonym 3-fluoro-5-trifluoromethyl benzoic acid,alpha,alpha,alpha,5-tetrafluoro-m-toluic acid,benzoic acid, 3-fluoro-5-trifluoromethyl,5-fluoro-3-trifluoromethyl benzoic acid,maybridge4_001933,acmc-1bwlq,intermediates-zcf02214,ksc496a7r,rarechem al bo 0634,buttpark 32\01-71
IUPAC Name 3-fluoro-5-(trifluoromethyl)benzoic acid
InChI Key NSGKIIGVPBTOBF-UHFFFAOYSA-M
Molecular Formula C8H3F4O2
10

2,4-Bis(trifluoromethyl)benzyl alcohol, 98%, Thermo Scientific™

CAS: 143158-15-0 Molecular Formula: C9H6F6O Molecular Weight (g/mol): 244.136 MDL Number: MFCD00042491 InChI Key: NDHDRXKQSOFDNV-UHFFFAOYSA-N PubChem CID: 2736131 IUPAC Name: [2,4-bis(trifluoromethyl)phenyl]methanol SMILES: C1=CC(=C(C=C1C(F)(F)F)C(F)(F)F)CO

PubChem CID 2736131
CAS 143158-15-0
Molecular Weight (g/mol) 244.136
MDL Number MFCD00042491
SMILES C1=CC(=C(C=C1C(F)(F)F)C(F)(F)F)CO
IUPAC Name [2,4-bis(trifluoromethyl)phenyl]methanol
InChI Key NDHDRXKQSOFDNV-UHFFFAOYSA-N
Molecular Formula C9H6F6O
11

2,4-Bis(trifluoromethyl)benzoic acid, 98%, Thermo Scientific™

CAS: 32890-87-2 Molecular Formula: C9H4F6O2 Molecular Weight (g/mol): 258.119 MDL Number: MFCD00042496 InChI Key: JTOIZLCQNWWDCN-UHFFFAOYSA-N Synonym: 2,4-bis trifluoromethyl benzoic acid,2,4-bis-trifluoromethylbenzoic acid,2,4-di trifluoromethyl benzoic acid,benzoic acid, 2,4-bis trifluoromethyl,2,4-bis-trifluoromethyl-benzoic acid,maybridge4_003283,acmc-20aoeb,pubchem8491,rarechem al bo 0512 PubChem CID: 141752 IUPAC Name: 2,4-bis(trifluoromethyl)benzoic acid SMILES: C1=CC(=C(C=C1C(F)(F)F)C(F)(F)F)C(=O)O

PubChem CID 141752
CAS 32890-87-2
Molecular Weight (g/mol) 258.119
MDL Number MFCD00042496
SMILES C1=CC(=C(C=C1C(F)(F)F)C(F)(F)F)C(=O)O
Synonym 2,4-bis trifluoromethyl benzoic acid,2,4-bis-trifluoromethylbenzoic acid,2,4-di trifluoromethyl benzoic acid,benzoic acid, 2,4-bis trifluoromethyl,2,4-bis-trifluoromethyl-benzoic acid,maybridge4_003283,acmc-20aoeb,pubchem8491,rarechem al bo 0512
IUPAC Name 2,4-bis(trifluoromethyl)benzoic acid
InChI Key JTOIZLCQNWWDCN-UHFFFAOYSA-N
Molecular Formula C9H4F6O2
12

Ethyl 3,5-bis(trifluoromethyl)benzoate, 99%, Thermo Scientific™

CAS: 96617-71-9 Molecular Formula: C11H8F6O2 Molecular Weight (g/mol): 286.17 MDL Number: MFCD01320684 InChI Key: NBWZJMOEFTYMOF-UHFFFAOYSA-N Synonym: ethyl 3,5-bis trifluoromethyl benzoate,3,5-bis-trifluoromethyl-benzoic acid ethyl ester,3,5-bis trifluoromethyl benzoic acid ethyl ester,rarechem al bi 0207,acmc-20al07,ethyl 3?5-bis trifluoromethyl benzoate,ethyl 3 5-bis trifluoromethyl benzoate,benzoic acid, 3,5-bis trifluoromethyl-, ethyl ester PubChem CID: 2733458 IUPAC Name: ethyl 3,5-bis(trifluoromethyl)benzoate SMILES: CCOC(=O)C1=CC(=CC(=C1)C(F)(F)F)C(F)(F)F

PubChem CID 2733458
CAS 96617-71-9
Molecular Weight (g/mol) 286.17
MDL Number MFCD01320684
SMILES CCOC(=O)C1=CC(=CC(=C1)C(F)(F)F)C(F)(F)F
Synonym ethyl 3,5-bis trifluoromethyl benzoate,3,5-bis-trifluoromethyl-benzoic acid ethyl ester,3,5-bis trifluoromethyl benzoic acid ethyl ester,rarechem al bi 0207,acmc-20al07,ethyl 3?5-bis trifluoromethyl benzoate,ethyl 3 5-bis trifluoromethyl benzoate,benzoic acid, 3,5-bis trifluoromethyl-, ethyl ester
IUPAC Name ethyl 3,5-bis(trifluoromethyl)benzoate
InChI Key NBWZJMOEFTYMOF-UHFFFAOYSA-N
Molecular Formula C11H8F6O2
13

3-Fluoro-4-(trifluoromethyl)benzyl alcohol, 97%, Thermo Scientific™

CAS: 230295-16-6 Molecular Formula: C8H6F4O Molecular Weight (g/mol): 194.129 MDL Number: MFCD00236285 InChI Key: MTBRNORZNYPTIU-UHFFFAOYSA-N Synonym: 3-fluoro-4-trifluoromethyl benzyl alcohol,3-fluoro-4-trifluoromethyl phenyl methanol,4-trifluoromethyl-3-fluorobenzyl alcohol,benzenemethanol, 3-fluoro-4-trifluoromethyl,3-fluoro-4-trifluoromethyl phenyl methan-1-ol,acmc-20amab,rarechem al bd 0450,benzenemethanol,3-fluoro-4-trifluoromethyl PubChem CID: 2737562 IUPAC Name: [3-fluoro-4-(trifluoromethyl)phenyl]methanol SMILES: C1=CC(=C(C=C1CO)F)C(F)(F)F

PubChem CID 2737562
CAS 230295-16-6
Molecular Weight (g/mol) 194.129
MDL Number MFCD00236285
SMILES C1=CC(=C(C=C1CO)F)C(F)(F)F
Synonym 3-fluoro-4-trifluoromethyl benzyl alcohol,3-fluoro-4-trifluoromethyl phenyl methanol,4-trifluoromethyl-3-fluorobenzyl alcohol,benzenemethanol, 3-fluoro-4-trifluoromethyl,3-fluoro-4-trifluoromethyl phenyl methan-1-ol,acmc-20amab,rarechem al bd 0450,benzenemethanol,3-fluoro-4-trifluoromethyl
IUPAC Name [3-fluoro-4-(trifluoromethyl)phenyl]methanol
InChI Key MTBRNORZNYPTIU-UHFFFAOYSA-N
Molecular Formula C8H6F4O
14

Methyl 3,5-bis(trifluoromethyl)benzoate, 98%, Thermo Scientific™

CAS: 26107-80-2 Molecular Formula: C10H6F6O2 Molecular Weight (g/mol): 272.146 MDL Number: MFCD00052317 InChI Key: LTYNBDAJUXZFHP-UHFFFAOYSA-N Synonym: methyl 3,5-bis trifluoromethyl benzoate,methyl 3,5-di trifluoromethyl benzoate radical,methyl3,5-bis trifluoromethyl benzoate,methyl 3,5-di trifluoromethyl benzoate,benzoic acid, 3,5-bis trifluoromethyl-, methyl ester,pubchem4989,acmc-209ygc,rarechem al bf 0207,buttpark 89\07-68,methyl 3,5-dicf3-benzoate radical PubChem CID: 141265 IUPAC Name: methyl 3,5-bis(trifluoromethyl)benzoate SMILES: COC(=O)C1=CC(=CC(=C1)C(F)(F)F)C(F)(F)F

PubChem CID 141265
CAS 26107-80-2
Molecular Weight (g/mol) 272.146
MDL Number MFCD00052317
SMILES COC(=O)C1=CC(=CC(=C1)C(F)(F)F)C(F)(F)F
Synonym methyl 3,5-bis trifluoromethyl benzoate,methyl 3,5-di trifluoromethyl benzoate radical,methyl3,5-bis trifluoromethyl benzoate,methyl 3,5-di trifluoromethyl benzoate,benzoic acid, 3,5-bis trifluoromethyl-, methyl ester,pubchem4989,acmc-209ygc,rarechem al bf 0207,buttpark 89\07-68,methyl 3,5-dicf3-benzoate radical
IUPAC Name methyl 3,5-bis(trifluoromethyl)benzoate
InChI Key LTYNBDAJUXZFHP-UHFFFAOYSA-N
Molecular Formula C10H6F6O2
15

4-Fluoro-3-(trifluoromethyl)benzoic acid, 98%, Thermo Scientific™

CAS: 67515-55-3 Molecular Formula: C8H3F4O2 Molecular Weight (g/mol): 207.10 MDL Number: MFCD00061294 InChI Key: WZBPZYCJUADXRS-UHFFFAOYSA-M Synonym: 4-fluoro-3-trifluoromethyl benzoic acid,4-fluoro-3-trifluomethyl benzoic acid,4-fluoro-3-trifluoromethyl benzoicacid,alpha,alpha,alpha,4-tetrafluoro-m-toluic acid,benzoic acid, 4-fluoro-3-trifluoromethyl,pubchem4972,acmc-1bafh,ksc495k5d,rarechem al bo 0636 PubChem CID: 522268 IUPAC Name: 4-fluoro-3-(trifluoromethyl)benzoic acid SMILES: [O-]C(=O)C1=CC=C(F)C(=C1)C(F)(F)F

PubChem CID 522268
CAS 67515-55-3
Molecular Weight (g/mol) 207.10
MDL Number MFCD00061294
SMILES [O-]C(=O)C1=CC=C(F)C(=C1)C(F)(F)F
Synonym 4-fluoro-3-trifluoromethyl benzoic acid,4-fluoro-3-trifluomethyl benzoic acid,4-fluoro-3-trifluoromethyl benzoicacid,alpha,alpha,alpha,4-tetrafluoro-m-toluic acid,benzoic acid, 4-fluoro-3-trifluoromethyl,pubchem4972,acmc-1bafh,ksc495k5d,rarechem al bo 0636
IUPAC Name 4-fluoro-3-(trifluoromethyl)benzoic acid
InChI Key WZBPZYCJUADXRS-UHFFFAOYSA-M
Molecular Formula C8H3F4O2