2-Amino-N,3-dimethylbenzamide

Base Information

• Chemical Name: 2-Amino-N,3-dimethylbenzamide
• CAS No.: 870997-57-2
• Molecular Formula: C9H12N2O
• Molecular Weight: 164.207
• Hs Code.: 2924299090
• DSSTox Substance ID: DTXSID70588163
• Wikidata: Q72436217
• Mol file: 870997-57-2.mol

Synonyms:2-AMINO-N,3-DIMETHYLBENZAMIDE;870997-57-2;SCHEMBL635088;DTXSID70588163;FBOWFVWOCBTBPH-UHFFFAOYSA-N;BCP30913;MFCD09042975;STL182345;2-Amino-3-methyl-N-methylbenzamide;AKOS000127207;MCULE-8215280285;BS-36085;CS-0232154;F87524;EN300-1264115;A841952;Z135505264

Chemical Property of 2-Amino-N,3-dimethylbenzamide

Chemical Property:

• Appearance/Colour: Pale yellow to white solid
• Vapor Pressure: 0.001mmHg at 25°C
• Melting Point: 115-117 °C
• Refractive Index: 1.574
• Boiling Point: 309.754 °C at 760 mmHg
• PKA: 15.22±0.46(Predicted)
• Flash Point: 141.135 °C
• PSA: 55.12000
• Density: 1.107 g/cm³
• LogP: 1.90890
• Storage Temp.: Keep in dark place,Inert atmosphere,Room temperature
• XLogP3: 1.4
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 1
• Exact Mass: 164.094963011
• Heavy Atom Count: 12
• Complexity: 170

Purity/Quality:

99.9% ^*data from raw suppliers

2-amino-N,3-dimethylbenzamide ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC1=C(C(=CC=C1)C(=O)NC)N

Technology Process of 2-Amino-N,3-dimethylbenzamide

There total 12 articles about 2-Amino-N,3-dimethylbenzamide 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: 96.0%

2-amino-5-bromo-N,3-dimethylbenzamide (890707-30-9) + sodium cyanide (143-33-9,25596-52-5) → N-methyl-3-methyl-2-aminobenzamide (870997-57-2) + 2-amino-3-methyl-5-cyanobenzoyl-N-methylamine (890707-29-6)

Guidance literature:

With polymethylhydrosiloxane; [(1,1′-bis(diphenylphosphino)ferrocene)Ni⁽⁰⁾(1,5-cyclooctadiene)]; In acetonitrile; at 70 - 72 ℃; for 3h; Product distribution / selectivity;

Reference yield: 92.0%

6-methylisatoic anhydride (66176-17-8) + methylamine (74-89-5) → N-methyl-3-methyl-2-aminobenzamide (870997-57-2)

Guidance literature:

With acetic acid; In water; ethyl acetate; at 35 - 37 ℃; for 3.33333h;

Reference yield: 92.0%

3-methylantranilic acid (4389-45-1) + methylamine (74-89-5) → N-methyl-3-methyl-2-aminobenzamide (870997-57-2)

Guidance literature:

3-methylantranilic acid; With 1,1'-carbonyldiimidazole; In tetrahydrofuran; at 40 ℃; for 3h;

methylamine; In tetrahydrofuran; at 20 ℃; for 1h;

upstream raw materials:

N-3-dimethyl-2-nitrobenzamide

3-methyl-2-sulfinylaminobenzoyl chloride

methylamine

3-methyl-2-nitrobenzoic acid

Downstream raw materials:

N-(2-methyl-6-methylcarbamoyl-phenyl)-oxalamic acid ethyl ester

2-amino-3-methyl-5-chlorobenzoyl-N-methylamine

2-amino-5-bromo-N,3-dimethylbenzamide

2-(4-methoxyphenyl)-3,8-dimethylquinazolin-4(3H)-one