3-Nitro-4-(trifluoromethyl)benzoic acid

Modify Date: 2024-01-10 18:57:10

3-Nitro-4-(trifluoromethyl)benzoic acid Structure
3-Nitro-4-(trifluoromethyl)benzoic acid structure
Common Name 3-Nitro-4-(trifluoromethyl)benzoic acid
CAS Number 116965-16-3 Molecular Weight 235.117
Density 1.6±0.1 g/cm3 Boiling Point 330.0±42.0 °C at 760 mmHg
Molecular Formula C8H4F3NO4 Melting Point 169ºC
MSDS N/A Flash Point 153.4±27.9 °C

 Names

Name 3-Nitro-4-(trifluoromethyl)benzoic acid
Synonym More Synonyms

 Chemical & Physical Properties

Density 1.6±0.1 g/cm3
Boiling Point 330.0±42.0 °C at 760 mmHg
Melting Point 169ºC
Molecular Formula C8H4F3NO4
Molecular Weight 235.117
Flash Point 153.4±27.9 °C
Exact Mass 235.009247
PSA 83.12000
LogP 3.09
Vapour Pressure 0.0±0.8 mmHg at 25°C
Index of Refraction 1.519

 Safety Information

Hazard Codes Xi: Irritant;
Risk Phrases R36/37/38
Safety Phrases 26-36/37/39
HS Code 2916399090

 Synthetic Route

~48%

3-Nitro-4-(trifluoromethyl)benzoic acid Structure

3-Nitro-4-(trif...

CAS#:116965-16-3

Literature: Merck and Co., Inc. Patent: US5262412 A1, 1993 ; US 5262412 A

~%

3-Nitro-4-(trifluoromethyl)benzoic acid Structure

3-Nitro-4-(trif...

CAS#:116965-16-3

Literature: Journal of Medicinal Chemistry, , vol. 47, # 12 p. 3163 - 3179

~25%

3-Nitro-4-(trifluoromethyl)benzoic acid Structure

3-Nitro-4-(trif...

CAS#:116965-16-3

Literature: Liebigs Annalen der Chemie, , # 6 p. 569 - 579

 Customs

HS Code 2916399090
Summary 2916399090 other aromatic monocarboxylic acids, their anhydrides, halides, peroxides, peroxyacids and their derivatives VAT:17.0% Tax rebate rate:9.0% Supervision conditions:none MFN tariff:6.5% General tariff:30.0%

 Synonyms

3-Nitro-4-(trifluoromethyl)benzoic acid
MFCD00274359
Benzoic acid, 3-nitro-4-(trifluoromethyl)-
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