3-Amino-2-methylbenzamide

Base Information

• Chemical Name: 3-Amino-2-methylbenzamide
• CAS No.: 374889-30-2
• Molecular Formula: C8H10 N2 O
• Molecular Weight: 150.18
• Hs Code.: 2924299090
• European Community (EC) Number: 863-772-5
• DSSTox Substance ID: DTXSID30586221
• Wikidata: Q82478306
• Mol file: 374889-30-2.mol

Synonyms:3-amino-2-methylbenzamide;374889-30-2;Benzamide,3-amino-2-methyl-;MFCD09028329;3-amino 2-metylbenzamide;SCHEMBL529786;DTXSID30586221;ZPA88930;BBL025748;STK727186;AKOS000103687;MCULE-6700056039;SB75900;AS-43696;DA-06341;SY129670;CS-0118460;EN300-37193;Z239125324

Chemical Property of 3-Amino-2-methylbenzamide

Chemical Property:

• Vapor Pressure: 0.002mmHg at 25°C
• Refractive Index: 1.616
• Boiling Point: 288.163°C at 760 mmHg
• PKA: 16.27±0.50(Predicted)
• Flash Point: 128.077°C
• PSA: 70.10000
• Density: 1.185g/cm³
• LogP: 2.14150
• XLogP3: 0.5
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 1
• Exact Mass: 150.079312947
• Heavy Atom Count: 11
• Complexity: 158

Purity/Quality:

98%Min ^*data from raw suppliers

3-amino-2-methylbenzamide ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC1=C(C=CC=C1N)C(=O)N

Technology Process of 3-Amino-2-methylbenzamide

There total 1 articles about 3-Amino-2-methylbenzamide 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: 91.0%

2-methyl-3-nitro-benzoic acid amide (290366-59-5) → 3-amino-2-methylbenzamide (374889-30-2)

Guidance literature:

palladium-carbon; In tetrahydrofuran; ethanol;

Reference yield: 89.0%

3-amino-2-methylbenzamide (374889-30-2) + 5-(5-ethyl-1,3,4-oxadiazol-2-yl)-2-phenylpyridine → 3-[3-ethyl-5-(6-phenylpyridin-3-yl)-4H-1,2,4-triazol-4-yl]-2-methylbenzamide (1416275-28-9,1446693-30-6)

Guidance literature:

With toluene-4-sulfonic acid; at 160 ℃; for 3h;

DOI:10.1021/jm400383w

Reference yield: 56.0%

3-amino-2-methylbenzamide (374889-30-2) + 5-[5-(3-methoxypropyl)-1,3,4-oxadiazol-2-yl]-2-phenylpyridine + camphor-10-sulfonic acid (76-26-6,3144-16-9,5872-08-2,35963-20-3,61380-66-3) → 3-[3-(3-Methoxypropyl)-5-(6-phenylpyridin-3-yl)-4H-1,2,4-triazol-4-yl]-2-methylbenzamide (374886-53-0)

Guidance literature:

In 1,3-dimethyl-2-imidazolidinone; chloroform;

upstream raw materials:

2-methyl-3-nitro-benzoic acid amide

Downstream raw materials:

3-[3-(3-Methoxypropyl)-5-(6-phenylpyridin-3-yl)-4H-1,2,4-triazol-4-yl]-2-methylbenzamide

3-(4-chloro-1,3,5-triazin-2-ylamino)-2-methylbenzamide

3-(4-(4-(3,4-dimethylphenyl)piperazin-1-yl)-1,3,5-triazin-2-ylamino)-2-methylbenzamide

3-(4-(4-hydroxypiperidin-1-yl)-1,3,5-triazin-2-ylamino)-N-methylbenzamide

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