2-BENZYLOXYETHYL CHLOROFORMATE

Base Information

• Chemical Name: 2-BENZYLOXYETHYL CHLOROFORMATE
• CAS No.: 56456-19-0
• Molecular Formula: C10H11ClO3
• Molecular Weight: 214.649
• Hs Code.: 2915900090
• European Community (EC) Number: 625-987-0
• DSSTox Substance ID: DTXSID50404296
• Wikidata: Q82208414
• Mol file: 56456-19-0.mol

Synonyms:2-BENZYLOXYETHYL CHLOROFORMATE

Chemical Property of 2-BENZYLOXYETHYL CHLOROFORMATE

Chemical Property:

• Vapor Pressure: 1.36 mm Hg ( 20 °C)
• Refractive Index: n20/D 1.508(lit.)
• Boiling Point: 282.7°C at 760 mmHg
• Flash Point: 230 °F
• PSA: 35.53000
• Density: 1.19 g/mL at 25 °C(lit.)
• LogP: 2.57860
• Storage Temp.: 2-8°C
• XLogP3: 2.5
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 6
• Exact Mass: 214.0396719
• Heavy Atom Count: 14
• Complexity: 167

Purity/Quality:

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

2-Benzyloxyethyl chloroformate 95% ^*data from reagent suppliers

Safty Information:

• Hazard Codes: C
• Statements: 34
• Safety Statements: 26-27-36/37/39-45

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1=CC=C(C=C1)COCCOC(=O)Cl

Technology Process of 2-BENZYLOXYETHYL CHLOROFORMATE

There total 2 articles about 2-BENZYLOXYETHYL CHLOROFORMATE 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:

bis(trichloromethyl) carbonate (32315-10-9) + 2-Benzyloxyethanol (622-08-2,1201808-31-2) → 2-(benzyloxy)ethyl chloroformate (56456-19-0)

Guidance literature:

With triethylamine; In dichloromethane; at 0 - 20 ℃; for 1.25h;

Reference yield:

phosgene (75-44-5) + 2-Benzyloxyethanol (622-08-2,1201808-31-2) → 2-(benzyloxy)ethyl chloroformate (56456-19-0)

Guidance literature:

With pyridine; In dichloromethane; toluene; at -60 - 15 ℃; for 0.25h;

DOI:10.1021/jm950717a

Reference yield: 92.0%

C32H66N5O8P + 2-(benzyloxy)ethyl chloroformate (56456-19-0) → C42H76N5O11P

Guidance literature:

With triethylamine; In dichloromethane; at 20 ℃; for 16h;

upstream raw materials:

phosgene

2-Benzyloxyethanol

bis(trichloromethyl) carbonate

Downstream raw materials:

3-Amino-5-[(2-benzyloxy-ethoxycarbonylamino)-methyl]-2,4,6-triiodo-benzoic acid

Dimethyl-carbamic acid 2-benzyloxy-ethyl ester

1-[2-(benzyloxy)ethyl] 4-methyl 4-[(4-phenyl-3,6-dihydropyridin-1(2H)-yl)sulfonyl]methylpiperidine-1,4-dicarboxylate

1-(2-benzyloxyethoxycarbonyl)-2-(4-thiazolyl)-benzimidazole

Refernces

• 1、 Chen, Ping,Cheng, Peter T. W.,Alam, Masud,Beyer, Barbara D.,Bisacchi, Gregory S.,Dejneka, Tamara,Evans, Adelaide J.,Greytok, Jill A.,Hermsmeier, Mark A.,Humphreys, W. Griffith,Jacobs, Glenn A.,Kocy, Octavian,Lin, Pin-Fang,Lis, Karen A.,Marella, Michael A.,Ryono, Denis E.,Sheaffer, Amy K.,Spergel, Steven H.,Sun, Chong-Qing,Tino, Joseph A.,Vite, Gregory,Colonno, Richard J.,Zahler, Robert,Barrish, Joel C.. "Aminodiol HIV protease inhibitors. Synthesis and structure - Activity relationships of P1/P1′ compounds: Correlation between lipophilicity and cytotoxicity". . p. 1991 - 2007. Retrieved 2007/10/03.