Bis(2-chloroethyl) carbonate

Base Information

• Chemical Name: Bis(2-chloroethyl) carbonate
• CAS No.: 623-97-2
• Deprecated CAS: 67522-32-1
• Molecular Formula: C5H8 Cl2 O3
• Molecular Weight: 187.023
• Hs Code.: 2920909090
• European Community (EC) Number: 210-823-9
• NSC Number: 6290
• UNII: MT82Z9427A
• DSSTox Substance ID: DTXSID50977859
• Nikkaji Number: J24.123G
• Wikidata: Q82963165
• Mol file: 623-97-2.mol

Synonyms:Bis(2-chloroethyl) carbonate;623-97-2;Carbonic acid bis(2-chloroethyl) ester;Bis(2-chloroethyl)carbonate;2-Chloroethyl carbonate;Ethanol, 2-chloro-, carbonate (2:1);Carbonic acid, bis(2-chloroethyl) ester;Ethamol, 2-chloro-, carbonate;AI3-18766;NSC 6290;EINECS 210-823-9;TL 259;Ethanol, 2-chloro-, 1,1'-carbonate;BRN 1762279;bis-(2-chloroethyl) carbonate;NSC-6290;4-03-00-00006 (Beilstein Handbook Reference);Carbonic Acid Bis(2-chloroethyl)Ester;carbonic acid bis-(2-chloroethyl) ester;Di(2-chloroethyl) Carbonate;SCHEMBL575181;C5-H8-Cl2-O3;WQULVXNWEYLDJY-UHFFFAOYSA-;DTXSID50977859;NSC6290;MT82Z9427A;MFCD00018962;Carbonic acid bis-(2-chloroethyl)ester;Carbonic Acid Di(2-chloroethyl) Ester;LS-51918;CS-0454407;FT-0632624;D89189

Chemical Property of Bis(2-chloroethyl) carbonate

Chemical Property:

• Vapor Pressure: 0.0352mmHg at 25°C
• Melting Point: 158-160 °C(lit.)
• Refractive Index: 1.447
• Boiling Point: 305-306 °C(lit.)
• Flash Point: 10 °C
• PSA: 35.53000
• Density: 2.596 g/mL at 25 °C(lit.)
• LogP: 1.61720
• XLogP3: 1.7
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 6
• Exact Mass: 185.9850495
• Heavy Atom Count: 10
• Complexity: 86.9

Purity/Quality:

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

Bis(2-chloroethyl) Carbonate >98.0%(GC) ^*data from reagent suppliers

Safty Information:

• Safety Statements: 22-24/25

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C(CCl)OC(=O)OCCCl

Technology Process of Bis(2-chloroethyl) carbonate

There total 7 articles about Bis(2-chloroethyl) carbonate 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:

oxirane (75-21-8,99932-75-9) + phosgene (75-44-5) → chloroethyl carbonate (623-97-2)

Guidance literature:

With pyridine; at -15 ℃;

DOI:10.1039/jr9570002735

Reference yield:

oxirane (75-21-8,99932-75-9) + 2-Chloroethyl chloroformate (627-11-2) → chloroethyl carbonate (623-97-2)

Guidance literature:

With pyridine;

DOI:10.1039/jr9570002735

Reference yield:

2-Chloroethyl chloroformate (627-11-2) + 2-chloro-ethanol (107-07-3) → chloroethyl carbonate (623-97-2)

Guidance literature:

at 130 - 150 ℃;

upstream raw materials:

oxirane

pyridine

phosgene

2-Chloroethyl chloroformate