Methyl morpholine-2-carboxylate

Base Information

• Chemical Name: Methyl morpholine-2-carboxylate
• CAS No.: 135782-19-3
• Molecular Formula: C6H11NO3
• Molecular Weight: 145.158
• Hs Code.: 2934999090
• European Community (EC) Number: 801-030-4
• DSSTox Substance ID: DTXSID20929148
• Mol file: 135782-19-3.mol

Synonyms:methyl morpholine-2-carboxylate;135782-19-3;methyl 2-morpholinecarboxylate;2-Morpholinecarboxylicacid,methylester(9CI);Morpholine-2-carboxylic acid methyl ester;2-Morpholinecarboxylic acid, methyl ester;(2)-MORPHOLINECARBOXYLIC ACID METHYL ESTER;SCHEMBL2910492;DTXSID20929148;RTITWBGWTASYEG-UHFFFAOYSA-N;MFCD11656588;METHYLMORPHOLINE-2-CARBOXYLATE;AKOS005264655;2-Morpholinecarboxylicacid,methyl ester;SB45186;SB45189;2-Morpholinecarboxylic acid methyl ester;AM803176;SY066084;EN300-53004;D88036

Chemical Property of Methyl morpholine-2-carboxylate

Chemical Property:

• Vapor Pressure: 0.295mmHg at 25°C
• Refractive Index: 1.437
• Boiling Point: 202.242 °C at 760 mmHg
• PKA: 7.77±0.40(Predicted)
• Flash Point: 76.114 °C
• PSA: 47.56000
• Density: 1.107 g/cm³
• LogP: -0.52340
• XLogP3: -0.6
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 2
• Exact Mass: 145.07389321
• Heavy Atom Count: 10
• Complexity: 126

Purity/Quality:

99% ^*data from raw suppliers

Methyl morpholine-2-carboxylate 97% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: COC(=O)C1CNCCO1

Technology Process of Methyl morpholine-2-carboxylate

There total 6 articles about Methyl morpholine-2-carboxylate 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%

Morpholine-2,4-dicarboxylic acid 4-benzyl ester 2-methyl ester (135782-22-8) → (RS)-2-(methoxycarbonyl)morpholine (135782-19-3,1314999-01-3)

Guidance literature:

With hydrogen; palladium on activated charcoal;

DOI:10.1016/S0040-4039(00)79702-4

Reference yield:

R,S-2-hydroxymethyl-4-benzylmorpholine (40987-24-4,943442-96-4) → (RS)-2-(methoxycarbonyl)morpholine (135782-19-3,1314999-01-3)

Guidance literature:

Multi-step reaction with 3 steps

1: 1.) H₂, 2.) Et₃N / 1.) 10percent Pd-C

3: 94 percent / H₂ / 10percent Pd-C

With hydrogen; triethylamine; palladium on activated charcoal;

DOI:10.1016/S0040-4039(00)79702-4

Reference yield:

4-(t-butyloxycarbonyl)morpholine-2-carboxylic acid methyl ester (500789-41-3) → (RS)-2-(methoxycarbonyl)morpholine (135782-19-3,1314999-01-3)

Guidance literature:

With hydrogenchloride; In 1,4-dioxane; dichloromethane; at 0 - 25 ℃; for 0.5h;

upstream raw materials:

Morpholine-2,4-dicarboxylic acid 4-benzyl ester 2-methyl ester

R,S-2-hydroxymethyl-4-benzylmorpholine

2-Hydroxymethyl-4-benzyloxycarbonyl-morpholine

4-(t-butyloxycarbonyl)morpholine-2-carboxylic acid methyl ester

Downstream raw materials:

methyl 3-carbomethoxy-4-oxo-1-piperidinecarboxylate

2-morpholinecarboxylic acid ethyl ester

Refernces

• 1、 -. "PYRIDINE DERIVATIVES AND THEIR USE IN THE TREATMENT OF PSYCHOTIC DISORDERS". Page/Page column 42-43. . Retrieved 2010/11/26.