3,5-Dinitro-4-methylbenzoic Acid

Modify Date: 2025-08-23 12:12:01

3,5-Dinitro-4-methylbenzoic Acid Structure
3,5-Dinitro-4-methylbenzoic Acid structure
Common Name 3,5-Dinitro-4-methylbenzoic Acid
CAS Number 16533-71-4 Molecular Weight 226.143
Density 1.6±0.1 g/cm3 Boiling Point 396.3±42.0 °C at 760 mmHg
Molecular Formula C8H6N2O6 Melting Point 155-158 °C(lit.)
MSDS Chinese USA Flash Point 176.1±16.3 °C
Symbol GHS07
GHS07
Signal Word Warning

 Names

Name 4-Methyl-3,5-dinitrobenzoic acid
Synonym More Synonyms

 Chemical & Physical Properties

Density 1.6±0.1 g/cm3
Boiling Point 396.3±42.0 °C at 760 mmHg
Melting Point 155-158 °C(lit.)
Molecular Formula C8H6N2O6
Molecular Weight 226.143
Flash Point 176.1±16.3 °C
Exact Mass 226.022583
PSA 128.94000
LogP 2.15
Vapour Pressure 0.0±1.0 mmHg at 25°C
Index of Refraction 1.639
InChIKey LZWWZQXBKVZKIP-UHFFFAOYSA-N
SMILES Cc1c([N+](=O)[O-])cc(C(=O)O)cc1[N+](=O)[O-]
Storage condition Flammables area

 Safety Information

Symbol GHS07
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
RIDADR NONH for all modes of transport
WGK Germany 3
HS Code 2916399090

 Synthetic Route

 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%

 Articles2

More Articles
Pd-catalyzed carbonylative lactamization: a novel synthetic approach to FR900482.

Org. Lett. 6 , 1745, (2004)

An asymmetric synthesis of the benzazocine core of FR900482 has been achieved in 15 steps from 3,5-dinitro-p-toluic acid. Key features of the synthesis include an enantioselective N-methylephedrine-me...

Identification of highly polar nitroaromatic compounds in leachate and ground water samples from a TNT-contaminated waste site by LC-MS, LC-NMR, and off-line NMR and MS investigations.

Anal. Bioanal. Chem 389(6) , 1979-88, (2007)

Leachate and ground water samples from a trinitrotoluene-contaminated waste disposal site near a former ammunitions plant in Stadtallendorf, Germany, were analyzed by liquid chromatography (LC)-mass s...

 Synonyms

3,5-Dinitro-4-methyl benzoic acid
Benzoic acid, 4-methyl-3,5-dinitro-
4-Methyl-3,5-dinitrobenzoic acid
3,5-Dinitro-4-toluic acid
3,5-Dinitro-p-toluic Acid
3,5-Dinitro-4-methylbenzoic Acid
EINECS 240-603-8
MFCD00007175
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