3-(Trifluoromethoxy)benzoic acid

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Names

[ CAS No. ]:
1014-81-9

[ Name ]:
3-(Trifluoromethoxy)benzoic acid

[Synonym ]:
EINECS 213-802-2
m-(Trifluoromethoxy)benzoic acid
QVR COXFFF
3-(Trifluoromethoxy)benzoicacid
3-Trifluormethoxy-benzoesaeure
3-trifluoromethoxy benzoic acid
Benzoic acid, 3-(trifluoromethoxy)-
α,α,α-Trifluoro-m-anisic acid
MFCD00041501
3-(Trifluoromethoxy)benzoic acid
3-trifluoromethyloxybenzoic acid

Chemical & Physical Properties

[ Density]:
1.4±0.1 g/cm3

[ Boiling Point ]:
243.8±35.0 °C at 760 mmHg

[ Melting Point ]:
89-92 °C(lit.)

[ Molecular Formula ]:
C8H5F3O3

[ Molecular Weight ]:
206.119

[ Flash Point ]:
101.2±25.9 °C

[ Exact Mass ]:
206.019073

[ PSA ]:
46.53000

[ LogP ]:
3.06

[ Vapour Pressure ]:
0.0±0.5 mmHg at 25°C

[ Index of Refraction ]:
1.478

MSDS

Click to get detail MSDS

Safety Information

[ Symbol ]:

GHS07

[ Signal Word ]:
Warning

[ Hazard Statements ]:
H315-H319-H335

[ Precautionary Statements ]:
P261-P305 + P351 + P338

[ Personal Protective Equipment ]:
dust mask type N95 (US);Eyeshields;Gloves

[ Hazard Codes ]:
Xi:Irritant;

[ Risk Phrases ]:
R36/37/38

[ Safety Phrases ]:
S26-S36-S37/39

[ RIDADR ]:
NONH for all modes of transport

[ WGK Germany ]:
3

[ HS Code ]:
2918990090

Synthetic Route

Click to get detail synthetic route

Precursor & DownStream

Precursor

  • Carbon dioxide
  • 1-Bromo-3-(trifluoromethoxy)benzene

DownStream

  • 3-(Trifluoromethoxy)benzhydrazide
  • 2-Nitro-5-(trifluoromethoxy)benzoic acid
  • 3-(Trifluoromethoxy)benzoic acid ethyl ester

Customs

[ HS Code ]: 2918990090

[ Summary ]:
2918990090. other carboxylic acids with additional oxygen function and their anhydrides, halides, peroxides and peroxyacids; their halogenated, sulphonated, nitrated or nitrosated derivatives. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:6.5%. General tariff:30.0%

Articles

NMR spectroscopic and theoretical chemistry studies on the internal acyl migration reactions of the 1-O-acyl-beta-D-glucopyranuronate conjugates of 2-, 3-, and 4-(trifluoromethyl) benzoic acids.

Chem. Res. Toxicol. 9(8) , 1414-24, (1996)

High resolution 19F NMR spectroscopy has been used to investigate the kinetics of internal acyl migration and hydrolysis of the synthetic beta -1-O-acyl-D-glucopyranuronates of 2-, 3-, and 4-(trifluor...


More Articles

Related Compounds

  • 4-Iodo-3-(trifluoromethoxy)benzoic acid
  • 2-Amino-3-(trifluoromethoxy)benzoic Acid
  • 6-bromo-3-(trifluoromethoxy)benzoic acid
  • 4-Amino-3-(trifluoromethoxy)benzoic acid
  • 4-Bromo-3-(trifluoromethoxy)benzoic acid
  • 2-Bromo-3-(trifluoromethoxy)benzoic acid
  • 6-[4-(dimethylamino)phenyl]-2,4,7-trimethyl-9aH-purino[7,8-a]imidazol-9-ium-1,3-dione
  • 4,7,8-trimethyl-6-(2-morpholin-4-ylethyl)-2-(2-oxopropyl)-9aH-purino[7,8-a]imidazol-6-ium-1,3-dione
  • 6-[(5-Amino-1,3,4-thiadiazol-2-yl)sulfanylmethyl]-2-(4-phenylpiperazin-1-yl)-1,3-diazinan-4-one
  • N-[2-(5-chloro-1H-indol-3-yl)ethyl]-4-(2,4-dioxo-4a,5,6,7,8,8a-hexahydro-1H-quinazolin-3-yl)butanamide
  • 6-[(5-Amino-1,3,4-thiadiazol-2-yl)sulfanylmethyl]-2-(4-ethylpiperazin-1-yl)-1,3-diazinan-4-one
  • 5-Butyl-6-methyl-2-[(4-methylquinazolin-2-yl)amino]-1,3-diazinan-4-one
  • 2-[(4,6-Dimethylquinazolin-2-yl)amino]-6-methyl-5-[(3-methylphenyl)methyl]-1,3-diazinan-4-one
  • 5-(4-Methylphenyl)-1-(2-phenylethyl)-4a,5,6,7,8,8a-hexahydropyrido[2,3-d]pyrimidine-2,4-dione
  • 6-Benzyl-3-[2-(2-methoxyphenoxy)ethylsulfanyl]-1,2,4-triazinan-5-one
  • 6-(3,4-Dimethoxyphenyl)-2-[(4,8-dimethylquinazolin-2-yl)amino]-1,3-diazinan-4-one
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