methyl N-carbamoylcarbamate

Base Information

• Chemical Name: methyl N-carbamoylcarbamate
• CAS No.: 761-89-7
• Molecular Formula: C3H6N2O3
• Molecular Weight: 118.092
• European Community (EC) Number: 684-746-8
• NSC Number: 48290
• UNII: 9HK6V636PF
• DSSTox Substance ID: DTXSID20226982
• Nikkaji Number: J55.358A
• Wikidata: Q27105730
• Metabolomics Workbench ID: 67627
• Mol file: 761-89-7.mol

Synonyms:Methyl allophanate;methyl N-carbamoylcarbamate;761-89-7;Carbomethoxyurea;allophanic acid methyl ester;ALLOPHANIC ACID, METHYL ESTER;USAF EL-70;methylcarbamoylcarbamate;1-(Methoxycarbonyl)urea;Methyl (aminocarbonyl)carbamate;Methyl N-(aminocarbonyl)carbamate;methyl carbamoylcarbamate;NSC 48290;BRN 1758683;Carbamic acid, carbamoyl-, methyl ester;9HK6V636PF;Carbamic acid, (aminocarbonyl)-, methyl ester;Carbamic acid,(aminocarbonyl)-, methyl ester (9CI);NSC-48290;4-03-00-00127 (Beilstein Handbook Reference);methylallophanate;allophanate methyl ester;WLN: ZVMVO1;UNII-9HK6V636PF;SCHEMBL376341;CHEBI:2600;DTXSID20226982;NSC48290;STL280256;AKOS005208672;LS-16361;N-Aminocarboxyl-carbamic acid methyl ester;FT-0621985;A838636;Q27105730;CARBAMIC ACID, N-(AMINOCARBONYL)-, METHYL ESTER

Chemical Property of methyl N-carbamoylcarbamate

Chemical Property:

• Refractive Index: 1.458
• PSA: 81.42000
• Density: 1.295 g/cm³
• LogP: 0.51230
• XLogP3: -0.3
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 1
• Exact Mass: 118.03784206
• Heavy Atom Count: 8
• Complexity: 111

Purity/Quality:

98%,99%, ^*data from raw suppliers

METHYL N-CARBAMOYLCARBAMATE AldrichCPR ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: COC(=O)NC(=O)N

Technology Process of methyl N-carbamoylcarbamate

There total 3 articles about methyl N-carbamoylcarbamate 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:

methanol (67-56-1) + cyanic acid (420-05-3) → allophanic acid methyl ester (761-89-7) + methyl carbamate (598-55-0)

Guidance literature:

Reference yield:

methanol (67-56-1) + diethyl ether (60-29-7,927820-24-4) + cyanic acid (420-05-3) → allophanic acid methyl ester (761-89-7) + methyl carbamate (598-55-0)

Guidance literature:

Reference yield:

methanol (67-56-1) + carbamoyl azide (13125-56-9) → N-methoxy-urea (3272-27-3) + allophanic acid methyl ester (761-89-7) + hydrazodicarboxamide (110-21-4) + nitrogen (7727-37-9)

Guidance literature:

In methanol; Irradiation (UV/VIS); reflux;

DOI:10.1016/S0040-4039(00)89962-1

upstream raw materials:

methanol

diethyl ether

cyanic acid

carbamoyl azide

Downstream raw materials:

1,1-Dimethylurea

N,N-diphenylurea

N,N'-bis phenyl imidodicarbonic diamide

N-phenylbiuret