Mephenesin carbamate

Base Information

• Chemical Name: Mephenesin carbamate
• CAS No.: 533-06-2
• Molecular Formula: C11H15 N O4
• Molecular Weight: 225.244
• Hs Code.: 2924299090
• European Community (EC) Number: 208-553-1
• NSC Number: 169508
• UNII: PAD6SXB23N
• DSSTox Substance ID: DTXSID201023823
• Nikkaji Number: J6.996E
• Wikidata: Q27286436
• Mol file: 533-06-2.mol

Synonyms:Mephenesin carbamate;Tolseram;Kimavoxyl;533-06-2;2-Hydroxy-3-(o-tolyloxy)propyl carbamate;SQ 2303;3-o-Toloxy-2-hydroxypropyl 1-carbamate;[2-hydroxy-3-(2-methylphenoxy)propyl] carbamate;2-Hydroxy-3-o-tolyloxypropyl 1-carbamate;3-o-Tolyloxy-2-hydroxypropyl 1-carbamate;NSC 169508;3-(2-Methylphenoxy)-1,2-propanediol 1-carbamate;3-o-Toloxy-1,2-propanediol 1-carbamic acid ester;1-Carbamoyloxy-2-hydroxy-3-(o-methylphenoxy)propane;CARBAMIC ACID, 2-HYDROXY-3-(o-TOLYLOXY)PROPYL ESTER;EINECS 208-553-1;UNII-PAD6SXB23N;PAD6SXB23N;1,2-Propanediol, 3-(o-tolyloxy)-, 1-carbamate;BRN 1880597;1,2-Propanediol,3-(o-tolyloxy)-,1-carbamate;1,2-Propanediol, 3-(2-methylphenoxy)-, 1-carbamate;NSC-169508;WLN: ZVO1YQ1OR B1;SCHEMBL3675710;MEPHENESIN CARBAMATE [MI];CHEBI:134925;1,3-(o-tolyloxy)-,1-carbamate;DTXSID201023823;1, 3-(o-tolyloxy)-, 1-carbamate;NSC169508;MC-2303;1, 3-(2-methylphenoxy)-, 1-carbamate;LS-49983;3-(O-Methylphenoxy)-1,2-propanediol carbamate;2-Hydroxy-3-(2-methylphenoxy)propyl carbamate #;Q27286436;carbamic acid [2-hydroxy-3-(2-methyl-phenoxy)-propyl] ester

Chemical Property of Mephenesin carbamate

Chemical Property:

• Vapor Pressure: 2.61E-09mmHg at 25°C
• Melting Point: about 93°; mp 80-84°
• Refractive Index: 1.5080 (estimate)
• Boiling Point: 461.4°Cat760mmHg
• Flash Point: 232.8°C
• PSA: 81.78000
• Density: 1.222g/cm³
• LogP: 1.53030
• XLogP3: 1.4
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 6
• Exact Mass: 225.10010796
• Heavy Atom Count: 16
• Complexity: 222

Purity/Quality:

98%min ^*data from raw suppliers

MEPHENESIN CARBAMATE 95.00% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC1=CC=CC=C1OCC(COC(=O)N)O
• Therapeutic Function: Muscle relaxant

Technology Process of Mephenesin carbamate

There total 4 articles about Mephenesin carbamate 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:

→ 2-hydroxy-3-(o-tolyloxy)propyl carbamate (533-06-2)

Guidance literature:

With ammonia;

DOI:10.1021/ja01156a536

Reference yield:

sodium o-cresolate (4549-72-8) → 2-hydroxy-3-(o-tolyloxy)propyl carbamate (533-06-2)

Guidance literature:

Multi-step reaction with 2 steps

1: H₂O

2: N,N-dimethyl-aniline; benzene / Behandeln einer Loesung des Reaktionsprodukts in Benzol mit wss. NH₃

With water; N,N-dimethyl-aniline; benzene;

DOI:10.1021/ja01164a108

Reference yield:

phosgene (75-44-5) + mephenesin (59-47-2) → 2-hydroxy-3-(o-tolyloxy)propyl carbamate (533-06-2)

Guidance literature:

With N,N-dimethyl-aniline; benzene; Behandeln einer Loesung des Reaktionsprodukts in Benzol mit wss. NH₃;

DOI:10.1021/ja01164a108

upstream raw materials:

phosgene

mephenesin

sodium o-cresolate

Refernces