4-(Trifluoroacetyl)benzoic acid

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Names

[ CAS No. ]:
58808-59-6

[ Name ]:
4-(Trifluoroacetyl)benzoic acid

[Synonym ]:
MFCD00052340
4-(2,2,2-trifluoroacetyl)benzoic acid
Benzoic acid, 4-(2,2,2-trifluoroacetyl)-
4-(Trifluoroacetyl)benzoic acid

Chemical & Physical Properties

[ Density]:
1.5±0.1 g/cm3

[ Boiling Point ]:
313.5±42.0 °C at 760 mmHg

[ Melting Point ]:
178 °C

[ Molecular Formula ]:
C9H5F3O3

[ Molecular Weight ]:
218.129

[ Flash Point ]:
143.4±27.9 °C

[ Exact Mass ]:
218.019073

[ PSA ]:
54.37000

[ LogP ]:
2.10

[ Vapour Pressure ]:
0.0±0.7 mmHg at 25°C

[ Index of Refraction ]:
1.494

MSDS

Click to get detail MSDS

Safety Information

[ Symbol ]:

GHS07

[ Signal Word ]:
Warning

[ Hazard Statements ]:
H315-H319-H335

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

[ Hazard Codes ]:
Xi: Irritant;

[ Risk Phrases ]:
R36/37/38

[ Safety Phrases ]:
S26-S36

[ RIDADR ]:
NONH for all modes of transport

[ HS Code ]:
2918300090

Synthetic Route

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Precursor & DownStream

Precursor

  • Methyl trifluoroacetate
  • 1,4-Dibromobenzene
  • 4-(trifluoroacetyl)toluene
  • Carbon dioxide
  • 4'-BROMO-2,2,2-TRIFLUOROACETOPHENONE
  • P-TOLYLMAGNESIUM BROMIDE
  • Benzaldehyde, 4-(trifluoroacetyl)- (9CI)
  • 4-Bromotoluene

DownStream

  • 4-(Trifluoroacetyl)benzoyl chloride
  • methyl 4-(2,2,2-trifluoroacetyl)benzoate

Customs

[ HS Code ]: 2918300090

[ Summary ]:
2918300090 other carboxylic acids with aldehyde or ketone function but without other oxygen function, their anhydrides, halides, peroxides, peroxyacids and their derivatives。Supervision conditions:None。VAT:17.0%。Tax rebate rate:9.0%。MFN tariff:6.5%。General tariff:30.0%

Related Compounds

  • 4-(trifluoroacetyl)benzoic acid chloride
  • CARBONATE IONOPHORE I
  • 4-[(Trifluoroacetyl)oxy]benzoic acid
  • Methyl 3-methyl-4-[(trifluoroacetyl)amino]benzoate
  • 2-Methyl-2-propanyl 2-nitro-4-[4-(trifluoroacetyl)-1-piperazinyl]benzoate
  • methyl 4-(2,2,2-trifluoroacetyl)benzoate