23218-93-1

Basic information

• Product Name: 3-AMINO-5-NITROBENZOIC ACID METHYL ESTER
• Synonyms: 3-AMINO-5-NITROBENZOIC ACID METHYL ESTER;Methyl 3-amino-5-nitrobenzoate;3-AMINO-5-NITRO-BENZOIC ACID METHYL ESTER >98%;5-Amino-3-nitrobenzoic acid methyl ester;3-(Methoxycarbonyl)-5-nitroaniline, 3-Amino-5-(methoxycarbonyl)nitrobenzene;Benzoic acid, 3-aMino-5-nitro-, Methyl ester;3-Amino-5-nitro-methylbenzoate
• CAS NO: 23218-93-1
• Molecular Formula: C₈H₈N₂O₄
• Molecular Weight: 196.16
• Mol File: 23218-93-1.mol
• Article Data: 12

Chemical Properties

• Melting Point: 165-166°C (dec.)
• Boiling Point: 0°C
• Flash Point: 0°C
• Appearance: /
• Density: 1.386 g/cm³
• Vapor Pressure: 2.18E-06mmHg at 25°C
• Refractive Index: 1.606
• Storage Temp.: under inert gas (nitrogen or Argon) at 2–8 °C
• PKA: 1.34±0.10(Predicted)
• CAS DataBase Reference: 3-AMINO-5-NITROBENZOIC ACID METHYL ESTER(CAS DataBase Reference)
• NIST Chemistry Reference: 3-AMINO-5-NITROBENZOIC ACID METHYL ESTER(23218-93-1)
• EPA Substance Registry System: 3-AMINO-5-NITROBENZOIC ACID METHYL ESTER(23218-93-1)

Safety Data

• Hazard Codes: Xi
• Statements: 36/37/38
• Safety Statements: 26-36
• Hazardous Substances Data: 23218-93-1(Hazardous Substances Data)

Usage

General Description

3-Amino-5-nitrobenzoic acid methyl ester is a chemical compound with the molecular formula C8H8N2O4. It is a derivative of benzoic acid and is used in organic synthesis as an intermediate for the production of pharmaceuticals, dyes, and agrochemicals. It is a yellow crystalline powder that is soluble in organic solvents like ethanol and acetone, and sparingly soluble in water. 3-Amino-5-nitrobenzoic acid methyl ester is a relatively stable compound, but it should be handled with care due to its potential for irritation to the skin, eyes, and respiratory system. It is important to follow proper safety procedures when working with this chemical.

InChI:InChI=1/C8H8N2O4/c1-14-8(11)5-2-6(9)4-7(3-5)10(12)13/h2-4H,9H2,1H3

Upstream product

• 2702-58-1 methyl 3,5-dinitrobenzoate 
• 67-56-1 methanol 
• 618-84-8 3-amino-5-nitro-benzoic acid 
• 99-34-3 3,5-dinitrobenzoic acid 
• 99-33-2 3,5-dinitrobenoyl chloride 

Downstream Products

• 14622-17-4 methyl 3-acetamido-5-nitrobenzoate 
• 35487-17-3 1-methylimidazolium chloride 
• 36138-28-0 3-chloro-5-nitro-benzoic acid methyl ester 
• 99066-80-5 methyl 3-cyano-5-nitrobenzoate 
• 632626-89-2 3-(1,1-dioxo-1/⁶-isothiazolidin-2-yl)-5-nitrobenzoic acid methyl ester 
• 632626-90-5 3-amino-5-(1,1-dioxo-1/⁶-isothiazolidin-2-yl)benzoic acid methyl ester 
• 632624-64-7 3-{2-[5-bromo-2-(2,4-difluorobenzyloxy)phenyl]-5-methyl-pyrrol-1-yl}-5-(1,1-dioxo-1/6-isothiazolidin-2-yl)benzoic acid 
• 632624-48-7 3-{2-[5-chloro-2-(2,3-difluorobenzyloxy)phenyl]-5-methyl-pyrrol-1-yl}-5-(1,1-dioxo-1/6-isothiazolidin-2-yl)benzoic acid 
• 632624-37-4 3-{2-[5-chloro-2-(2,6-difluorobenzyloxy)phenyl]-5-methyl-pyrrol-1-yl}-5-(1,1-dioxo-1/6-isothiazolidin-2-yl)benzoic acid 
• 632624-24-9 3-{2-[5-chloro-2-(4-bromo-2-fluorobenzyloxy)phenyl]-5-methyl-pyrrol-1-yl}-5-(1,1-dioxo-1/6-isothiazolidin-2-yl)benzoic acid 

Relevant articles and documents

FE NANOPARTICLES WITH PPM CONTENTS OF PD, CU AND/OR NI, REACTIONS IN WATER CATALYZED BY THEM

The present application discloses a nanoparticle composition prepared from a mixture comprising: a) a transition metal salt; b) an iron salt; and c) a reducing agent; and methods for the use of such compositions, including the reduction of an organic compound comprising a nitro group to form an organic compound comprising an amine group, the Cu-catalyzed cyclization of an azide and an alkyne (click chemistry) and cross coupling reactions, notably Suzuki-Miyaura reactions. The transition metal salts are in particular Pd, Cu and Ni salts, the content of these metals being typically in the ppm range based on the major constituent Fe in the final products.

Bioreduction of aryl azides during mutasynthesis of new ansamitocins

Supplementing a culture of a mutant strain of Actinosynnema pretiosum that is unable to biosynthesize aminohydroxy benzoic acid (AHBA), with 3-azido-5-hydroxy-benzoic acid and 3-azido-5-amino-benzoic acid, unexpectedly yielded anilino ansamitocins instead

Pteridinone derivatives as PI3-kinases inhibitors

New compounds of formula 1 are provided which by virtue of their pharmaceutical activity as PI3-kinase modulators may be used in the therapeutic field for the treatment of inflammatory or allergic diseases. Examples of these include inflammatory and allergic respiratory complaints, inflammatory diseases of the gastro-intestinal tract and motor apparatus, inflammatory and allergic skin diseases, inflammatory eye diseases, diseases of the nasal mucosa, inflammatory or allergic conditions involving autoimmune reactions or inflammations of the kidney.