Carbamic acid, (3-chloro-3-oxopropyl)-, 1,1-dimethylethyl ester (9CI)

Base Information

• Chemical Name: Carbamic acid, (3-chloro-3-oxopropyl)-, 1,1-dimethylethyl ester (9CI)
• CAS No.: 57591-79-4
• Molecular Formula: C8H14ClNO3
• Molecular Weight: 207.65466
• Mol file: 57591-79-4.mol

Synonyms:Carbamic acid, (3-chloro-3-oxopropyl)-, 1,1-dimethylethyl ester (9CI)

Chemical Property of Carbamic acid, (3-chloro-3-oxopropyl)-, 1,1-dimethylethyl ester (9CI)

Chemical Property:

• Boiling Point: 290.4±23.0 °C(Predicted)
• PKA: 12.08±0.46(Predicted)
• PSA: 55.40000
• Density: 1.144±0.06 g/cm3(Predicted)
• LogP: 2.05750

Purity/Quality:

98%Min ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

Technology Process of Carbamic acid, (3-chloro-3-oxopropyl)-, 1,1-dimethylethyl ester (9CI)

There total 1 articles about Carbamic acid, (3-chloro-3-oxopropyl)-, 1,1-dimethylethyl ester (9CI) 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:

3-(tert-butyloxycarbonylamino)propionic acid (3303-84-2) → C8H14ClNO3 (57591-79-4)

Guidance literature:

With pyridine; oxalyl dichloride; In tetrahydrofuran; DMF (N,N-dimethyl-formamide); at 0 - 20 ℃; for 1h;

Reference yield: 63.82%

C8H14ClNO3 (57591-79-4) + (2R)-2-[(tert-butoxycarbonyl)amino]-3-phenylpropylamine (185384-16-1,179051-72-0) → 3-[(tert-butoxycarbonyl)amino]-N-[(2R)-2-[(tert-butoxycarbonyl)amino]-3-phenylpropyl]propionamide hydrochloride

Guidance literature:

With triethylamine; In tetrahydrofuran; at 0 ℃; Inert atmosphere;

DOI:10.1016/j.bmc.2008.10.025

Reference yield:

C8H14ClNO3 (57591-79-4) + 2-bromoaniline (615-36-1) → N-(2-bromophenyl)-3-(tert-butoxycarbonylamino)propanecarboxamide (561030-78-2)

Guidance literature:

With dmap; triethylamine; In tetrahydrofuran; DMF (N,N-dimethyl-formamide); acetonitrile; at 0 - 20 ℃; for 20h;

upstream raw materials:

3-(tert-butyloxycarbonylamino)propionic acid

Downstream raw materials:

N-(2-bromophenyl)-3-(tert-butoxycarbonylamino)propanecarboxamide

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