3-Amino-2-methyl-5-nitrobenzamide

Base Information

• Chemical Name: 3-Amino-2-methyl-5-nitrobenzamide
• CAS No.: 3572-44-9
• Molecular Formula: C8H9N3O3
• Molecular Weight: 195.1754
• Hs Code.: 2924299090
• European Community (EC) Number: 684-517-2
• UNII: KA9YLT68HA
• DSSTox Substance ID: DTXSID00189243
• Nikkaji Number: J15.123H
• Wikidata: Q27282148
• ChEMBL ID: CHEMBL510184
• Mol file: 3572-44-9.mol

Synonyms:3-Amino-2-methyl-5-nitrobenzamide;Anot;3572-44-9;3-ANOT;3-Amino-5-nitro-o-toluamide;Benzamide, 3-amino-2-methyl-5-nitro-;o-TOLUAMIDE, 3-AMINO-5-NITRO-;UNII-KA9YLT68HA;KA9YLT68HA;BRN 2114950;2-Methyl-3-amino-5-nitrobenzamide;ANOT [MI];3-Amino-5-nitro-o-toluamid;SCHEMBL377142;CHEMBL510184;DTXSID00189243;3572-44-9 (non-salt);AKOS040758079;HY-136458;LS-153963;CS-0129634;3-Amino-2-methyl-5-nitrobenzamide hydrochloride;Q27282148;3-Amino-2-methyl-5-nitrobenzamide, VETRANAL(TM), analytical standard;3-Amino-2-methyl-5-nitrobenzamide. Short expiry date due to chemical nature of component(s)

Chemical Property of 3-Amino-2-methyl-5-nitrobenzamide

Chemical Property:

• Vapor Pressure: 9.3E-05mmHg at 25°C
• Melting Point: 198.5-199.5°
• Boiling Point: 339.3°Cat760mmHg
• Flash Point: 159°C
• PSA: 115.92000
• Density: 1.408g/cm³
• LogP: 2.57290
• Storage Temp.: Refrigerator
• Solubility.: DMSO (Slightly), Methanol (Slightly)
• XLogP3: 0.3
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 1
• Exact Mass: 195.06439116
• Heavy Atom Count: 14
• Complexity: 251

Purity/Quality:

98%Min ^*data from raw suppliers

3-Amino-5-nitro-o-toluamide ^*data from reagent suppliers

Safty Information:

• Pictogram(s): 2114950
• Hazard Codes: Xi
• Statements: 36/37/38
• Safety Statements: 26

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC1=C(C=C(C=C1N)[N+](=O)[O-])C(=O)N
• Uses: 3-Amino-5-nitro-o-toluamide is a metabolite of the veterinary drug zoalene.

Technology Process of 3-Amino-2-methyl-5-nitrobenzamide

There total 1 articles about 3-Amino-2-methyl-5-nitrobenzamide which guide to synthetic route it. The literature collected by LookChem mainly comes from the sharing of users and the free literature resources found by Internet computing technology. We keep the original model of the professional version of literature to make it easier and faster for users to retrieve and use. At the same time, we analyze and calculate the most feasible synthesis route with the highest yield for your reference as below:

synthetic route:

Reference yield:

zoalene (148-01-6) → 3-amino-5-nitro-o-toluamide (90223-31-7) + 5-amino-3-nitro-o-toluamide (3572-44-9)

Guidance literature:

With palladium on activated charcoal; cyclohexene; In ethanol; at 51 ℃;

DOI:10.1021/jf9802068

upstream raw materials:

zoalene

Refernces