4-Methoxycarbonyl-3-nitrobenzoic acid
[CAS# 35092-89-8]

Identification

• Classification: Chemical reagent >> Organic reagent >> Nitro compound
• Name: 4-Methoxycarbonyl-3-nitrobenzoic acid
• Synonyms: 1-Nitrobenzene-2-methyloxycarbonyl-5-carboxylic acid; 2-Nitroterephthalic acid 1-methyl ester; 4-Methoxycarbonyl-3-nitrobenzoic acid; Methyl 4-carboxy-2-nitrobenzoate; NSC 151109
• Molecular Formula: C₉H₇NO₆
• Molecular Weight: 225.15
• CAS Registry Number: 35092-89-8
• EC Number: 252-360-5

Properties

• Solubility: Very slightly soluble (0.68 g/L) (25 ºC), Calc.^*
• Density: 1.484±0.06 g/cm³ (20 ºC 760 Torr), Calc.^*
• Melting point: 177-179 ºC (water )^**

^* Calculated using Advanced Chemistry Development (ACD/Labs) Software V11.02 (©1994-2020 ACD/Labs)

^** Wagner, Carl E.; Journal of Medicinal Chemistry 2009, V52(19), P5950-5966.

Safety Data

Hazard Classification

Hazard	Class	Category Code	Hazard Statement
Eye irritation	Eye Irrit.	2	H319
Chronic hazardous to the aquatic environment	Aquatic Chronic	3	H412
Skin irritation	Skin Irrit.	2	H315
Specific target organ toxicity - single exposure	STOT SE	3	H335
Acute hazardous to the aquatic environment	Aquatic Acute	3	H402