Glycine, N-(2-hydroxybenzoyl)-, methyl ester

Base Information

• Chemical Name: Glycine, N-(2-hydroxybenzoyl)-, methyl ester
• CAS No.: 55493-89-5
• Molecular Formula: C10H11NO4
• Molecular Weight: 209.1986
• DSSTox Substance ID: DTXSID30204074
• Nikkaji Number: J104.938K
• Wikidata: Q83077528
• Mol file: 55493-89-5.mol

Synonyms:Methyl salicylurate;55493-89-5;Glycine, N-(2-hydroxybenzoyl)-, methyl ester;Methyl o-hydroxyhippurate;N-(2-Hydroxybenzoyl)glycine methyl ester;o-Hydroxyhippuric , methyl ester;DTXSID30204074;PXFSDQXXIDCRPA-UHFFFAOYSA-N;o-Hydroxyhippuric acid methyl ester;AKOS000207500;Methyl [(2-hydroxybenzoyl)amino]acetate #;METHYL N-(2-HYDROXYBENZOYL)GLYCINATE

Chemical Property of Glycine, N-(2-hydroxybenzoyl)-, methyl ester

Chemical Property:

• Vapor Pressure: 3.33E-07mmHg at 25°C
• Boiling Point: 406.9°Cat760mmHg
• Flash Point: 199.9°C
• PSA: 79.12000
• Density: 1.27g/cm³
• LogP: 0.86980
• XLogP3: 1.3
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 4
• Exact Mass: 209.06880783
• Heavy Atom Count: 15
• Complexity: 242

Purity/Quality:

99% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: COC(=O)CNC(=O)C1=CC=CC=C1O

Technology Process of Glycine, N-(2-hydroxybenzoyl)-, methyl ester

There total 2 articles about Glycine, N-(2-hydroxybenzoyl)-, methyl ester 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: 54.0%

glycine ethyl ester hydrochloride (5680-79-5,883886-67-7) + salicylic acid (69-72-7,25496-36-0,8052-31-1) → salicyluric acid methyl ester (55493-89-5)

Guidance literature:

salicylic acid; With N-ethyl-N,N-diisopropylamine; N-[(dimethylamino)-3-oxo-1H-1,2,3-triazolo[4,5-b]pyridin-1-yl-methylene]-N-methylmethanaminium hexafluorophosphate; In N,N-dimethyl-formamide; for 0.25h;

glycine ethyl ester hydrochloride; In N,N-dimethyl-formamide; for 12h;

DOI:10.1039/c8ob01773e

Reference yield:

methanol (67-56-1) + Salicyluric acid (487-54-7) → salicyluric acid methyl ester (55493-89-5)

Guidance literature:

With hydrogenchloride;

DOI:10.1002/hlca.19570400533

Reference yield:

salicyluric acid methyl ester (55493-89-5) → Salicyluric acid (487-54-7)

Guidance literature:

Multi-step reaction with 2 steps

1: methanol. NH₃

2: aqueous NaOH

With sodium hydroxide; ammonia;

DOI:10.1002/hlca.19570400533

upstream raw materials:

methanol

Salicyluric acid

glycine ethyl ester hydrochloride

salicylic acid

Downstream raw materials:

N-Salicyloyl-glycin-amid

Salicyluric acid