Ethyl 2-methyl-2-(phenylcarbamoyloxy)propanoate

Base Information

• Chemical Name: Ethyl 2-methyl-2-(phenylcarbamoyloxy)propanoate
• CAS No.: 6935-13-3
• Molecular Formula: C13H17NO4
• Molecular Weight: 251.2784
• NSC Number: 58522
• DSSTox Substance ID: DTXSID90289004
• Wikidata: Q82026151
• Mol file: 6935-13-3.mol

Synonyms:6935-13-3;ethyl 2-methyl-2-(phenylcarbamoyloxy)propanoate;NSC58522;DTXSID90289004;NSC-58522

Chemical Property of Ethyl 2-methyl-2-(phenylcarbamoyloxy)propanoate

Chemical Property:

• Vapor Pressure: 0.000582mmHg at 25°C
• Boiling Point: 310.9°Cat760mmHg
• Flash Point: 141.8°C
• Density: 1.169g/cm³
• XLogP3: 2.4
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 6
• Exact Mass: 251.11575802
• Heavy Atom Count: 18
• Complexity: 295

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCOC(=O)C(C)(C)OC(=O)NC1=CC=CC=C1

Technology Process of Ethyl 2-methyl-2-(phenylcarbamoyloxy)propanoate

There total 2 articles about Ethyl 2-methyl-2-(phenylcarbamoyloxy)propanoate 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:

phenyl isocyanate (103-71-9) + ethyl 2-hydroxy-2,2-dimethylethanoate (80-55-7) → 2-(N-Phenyl-carbamoyloxy)-isobuttersaeure-aethylester (6935-13-3)

Guidance literature:

at 180 ℃;

Reference yield:

phenyl isocyanate (103-71-9) + ethyl 2-hydroxy-2,2-dimethylethanoate (80-55-7) → 2-(N-Phenyl-carbamoyloxy)-isobuttersaeure-aethylester (6935-13-3)

Guidance literature:

at 180 ℃;

Reference yield:

1-methyl-4-nitrosobenzene (623-11-0) + 2-(N-Phenyl-carbamoyloxy)-isobuttersaeure-aethylester (6935-13-3) → α-phenylcarbamoyloxy-isobutyric acid (99856-18-5) + 2-hydroxy-2-methylpropionanilide (2760-38-5)

Guidance literature:

at 20 ℃; Product distribution;

upstream raw materials:

phenyl isocyanate

ethyl 2-hydroxy-2,2-dimethylethanoate

Downstream raw materials:

α-phenylcarbamoyloxy-isobutyric acid

2-hydroxy-2-methylpropionanilide