Methallyl carbamate

Base Information

• Chemical Name: Methallyl carbamate
• CAS No.: 2114-14-9
• Molecular Formula: C5H9 N O2
• Molecular Weight: 115.13
• Hs Code.: 2924199090
• European Community (EC) Number: 654-647-4
• NSC Number: 66325
• UNII: 0CB506VO6N
• DSSTox Substance ID: DTXSID10175379
• Nikkaji Number: J42.902C
• Wikidata: Q83045700
• Mol file: 2114-14-9.mol

Synonyms:Methallyl carbamate;2114-14-9;2-methylprop-2-enyl carbamate;CARBAMIC ACID, 2-METHYLALLYL ESTER;(2-methylprop-2-en-1-yl) carbamate;0CB506VO6N;2-Methyl-2-propen-1-ol carbamate;NSC 66325;NSC-66325;2-Propen-1-ol, 2-methyl-, carbamate;BRN 2959681;AI3-02681;2-Methylallyl carbamate;2-Propen-1-ol, carbamate;NCIOpen2_000070;UNII-0CB506VO6N;SCHEMBL9445541;DTXSID10175379;MNPKKYZUEZVQNJ-UHFFFAOYSA-N;NSC66325;AKOS006342745;Carbamic acid 2-methyl-2-propenyl ester;LS-50044;2-PROPEN-1-OL, 2-METHYL-, 1-CARBAMATE;2-Propen-1-ol, 2-methyl-, carbamate (8CI,9CI)

Chemical Property of Methallyl carbamate

Chemical Property:

• Vapor Pressure: 0.153mmHg at 25°C
• Melting Point: 51-52 °C
• Boiling Point: 214.8°Cat760mmHg
• PKA: 13.32±0.50(Predicted)
• Flash Point: 105.6°C
• PSA: 52.32000
• Density: 1.017g/cm³
• LogP: 1.35810
• XLogP3: 0.8
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 3
• Exact Mass: 115.063328530
• Heavy Atom Count: 8
• Complexity: 109

Purity/Quality:

99%min ^*data from raw suppliers

(2-Methylprop-2-en-1-yl)Carbamate ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC(=C)COC(=O)N
• Uses: (2-Methylprop-2-en-1-yl) Carbamate is a useful reagent for carbamoylation reactions. It is used in the stereoselective synthesis of acyclic 1,?3-?diol systems.

Technology Process of Methallyl carbamate

There total 1 articles about Methallyl 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:

C7H8Cl3NO3 → Methallylcarbamat (2114-14-9)

Guidance literature:

With water; potassium carbonate; In methanol; at 0 - 20 ℃; for 3h; Inert atmosphere;

DOI:10.1016/j.tet.2014.06.051

Refernces