Carbamic acid, hydroxymethyl-, ethyl ester

Base Information

• Chemical Name: Carbamic acid, hydroxymethyl-, ethyl ester
• CAS No.: 5027-16-7
• Molecular Formula: C4H9 N O3
• Molecular Weight: 119.12
• Hs Code.: 2924199090
• European Community (EC) Number: 225-717-8
• NSC Number: 20520
• UNII: 2K6KHS1VQ7
• DSSTox Substance ID: DTXSID50198269
• Nikkaji Number: J42.897C
• Wikidata: Q83071044
• Mol file: 5027-16-7.mol

Synonyms:5027-16-7;ethyl (hydroxymethyl)carbamate;ethyl N-(hydroxymethyl)carbamate;CARBAMIC ACID, HYDROXYMETHYL-, ETHYL ESTER;Ethyl methylolcarbamate;Monomethylol ethyl carbamate;Ethyl (hydroxymethyl)-carbamate;Ethyl hydroxymethylcarbamate;EINECS 225-717-8;NSC 20520;BRN 1811790;2K6KHS1VQ7;NSC-20520;0-03-00-00024 (Beilstein Handbook Reference);Methylolurethan;N-hydroxymethyl urethane;UNII-2K6KHS1VQ7;SCHEMBL602822;DTXSID50198269;NSC20520;AKOS006277953;(Hydroxymethyl)carbamic acid ethyl ester;LS-49958;Carbamic acid, (hydroxymethyl)-, ethyl ester

Chemical Property of Carbamic acid, hydroxymethyl-, ethyl ester

Chemical Property:

• Vapor Pressure: 0.0134mmHg at 25°C
• Melting Point: 53 °C
• Boiling Point: 229.4°Cat760mmHg
• PKA: 11.27±0.46(Predicted)
• Flash Point: 92.5°C
• PSA: 58.56000
• Density: 1.141g/cm³
• LogP: 0.07320
• XLogP3: -0.3
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 3
• Exact Mass: 119.058243149
• Heavy Atom Count: 8
• Complexity: 73.7

Purity/Quality:

99% ^*data from raw suppliers

Ethyl(hydroxymethyl)carbamate 97% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

Useful:

• Canonical SMILES: CCOC(=O)NCO

Technology Process of Carbamic acid, hydroxymethyl-, ethyl ester

There total 3 articles about Carbamic acid, hydroxymethyl-, ethyl 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: 100.0%

formaldehyd (50-00-0,30525-89-4,61233-19-0) + urethane (51-79-6) → ethyl N-(hydroxymethyl)carbamate (5027-16-7)

Guidance literature:

With potassium carbonate; In benzene; at 70 - 75 ℃; for 3.5h;

DOI:10.1016/S0040-4020(01)86443-7

Reference yield:

methyl chloroformate (79-22-1) → ethyl N-(hydroxymethyl)carbamate (5027-16-7)

Guidance literature:

With sodium hydroxide; hydroxylamine hydrochloride; In water;

Reference yield:

→ ethyl N-(hydroxymethyl)carbamate (5027-16-7)

Guidance literature:

Ethyl-azidoformiat; Me.; hν;

DOI:10.1016/S0040-4039(01)89432-6

upstream raw materials:

formaldehyd

urethane

methyl chloroformate

Downstream raw materials:

(2-hydroxy-3,5-dimethyl-benzyl)-carbamic acid ethyl ester

2-ethoxy-5r-methyl-6t-phenyl-5,6-dihydro-4H-[1,3]oxazine

N,N'-methanediyl-bis-carbamic acid diethyl ester

Refernces

• 1、 Kepler, John A.,Taylor, George F.. "An Unequivocal Synthesis of (Methylazoxy)methanol Acetate and (Methylazoxy)methanol Acetate". . p. 453 - 455. Retrieved 2007/10/02.