Methyl 2-amino-4,5-dimethylbenzoate

Base Information

• Chemical Name: Methyl 2-amino-4,5-dimethylbenzoate
• CAS No.: 19258-73-2
• Molecular Formula: C10H13 N O2
• Molecular Weight: 179.219
• Hs Code.: 2922499990
• European Community (EC) Number: 831-160-7
• NSC Number: 106591
• DSSTox Substance ID: DTXSID20295971
• Wikidata: Q82036234
• Mol file: 19258-73-2.mol

Synonyms:methyl 2-amino-4,5-dimethylbenzoate;19258-73-2;METHYL 2-AMINO-4,5-DIMETHYL-BENZOATE;Benzoic acid, 2-amino-4,5-dimethyl-, methyl ester;MFCD11505980;methyl 4,5-dimethyl-2-aminobenzoate;NSC106591;SCHEMBL681252;DTXSID20295971;OEBNORXUIYOXGB-UHFFFAOYSA-N;methyl2-amino-4,5-dimethylbenzoate;AKOS006325672;NSC-106591;SB34733;BS-16220;BB 0257624;CS-0103968;FT-0732730;EN300-365474;W11217;Methyl 2-amino-4,5-dimethyl-benzoate, AldrichCPR;Z1198323422

Chemical Property of Methyl 2-amino-4,5-dimethylbenzoate

Chemical Property:

• Vapor Pressure: 0.00155mmHg at 25°C
• Boiling Point: 295.2°Cat760mmHg
• PKA: 2.74±0.10(Predicted)
• Flash Point: 151.6°C
• PSA: 52.32000
• Density: 1.105g/cm³
• LogP: 2.25340
• Storage Temp.: Sealed in dry,Room Temperature
• XLogP3: 2.4
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 2
• Exact Mass: 179.094628657
• Heavy Atom Count: 13
• Complexity: 193

Purity/Quality:

98% ^*data from raw suppliers

Methyl2-amino-4,5-dimethylbenzoate ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC1=CC(=C(C=C1C)N)C(=O)OC

Technology Process of Methyl 2-amino-4,5-dimethylbenzoate

There total 3 articles about Methyl 2-amino-4,5-dimethylbenzoate 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: 94.0%

methanol (67-56-1) + 2-amino-4,5-dimethylbenzoic acid (15089-51-7) → methyl 2-amino-4,5-dimethylbenzoate (19258-73-2)

Guidance literature:

With sulfuric acid; at 60 ℃; for 64.5h; Inert atmosphere;

Reference yield:

2-amino-4,5-dimethylbenzoic acid (15089-51-7) + diazomethyl-trimethyl-silane (18107-18-1) → methyl 2-amino-4,5-dimethylbenzoate (19258-73-2)

Guidance literature:

Reference yield:

→ methyl 2-amino-4,5-dimethylbenzoate (19258-73-2)

Guidance literature:

Carbonsaeure IVa, methanol. HCl;

upstream raw materials:

2-amino-4,5-dimethylbenzoic acid

diazomethyl-trimethyl-silane

methanol