2-(2-Chloroethoxy)-1,1,1-trifluoroethane

Base Information

• Chemical Name: 2-(2-Chloroethoxy)-1,1,1-trifluoroethane
• CAS No.: 1537-70-8
• Molecular Formula: C4H6ClF3O
• Molecular Weight: 162.539
• Hs Code.: 2909199090
• European Community (EC) Number: 828-873-0
• DSSTox Substance ID: DTXSID90594105
• Wikidata: Q82488837
• Mol file: 1537-70-8.mol

Synonyms:1537-70-8;5-chloro-1,1,1-trifluoro-3-oxapentane;2-(2-Chloroethoxy)-1,1,1-trifluoroethane;5-CHLORO-1,1,1-TRIFLUORO-3-OXAPENTANE 97;MFCD00462515;2-Chloroethyl 2,2,2-trifluoroethyl ether;2-(2-chloroethoxy)-1,1,1-trifluoro-ethane;SCHEMBL6999698;DTXSID90594105;PSPSSKGNQJKXHK-UHFFFAOYSA-N;AKOS009293952;AS-47635;F14730;A809464;5-Chloro-1,1,1-trifluoro-3-oxapentane, 2-(2-Chloroethoxy)-1,1,1-trifluoroethane

Chemical Property of 2-(2-Chloroethoxy)-1,1,1-trifluoroethane

Chemical Property:

• Vapor Pressure: 26.2mmHg at 25°C
• Boiling Point: 112°C at 760 mmHg
• Flash Point: 21.5°C
• PSA: 9.23000
• Density: 1.262g/cm³
• LogP: 1.80410
• XLogP3: 1.8
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 3
• Exact Mass: 162.0059270
• Heavy Atom Count: 9
• Complexity: 72.7

Purity/Quality:

97% ^*data from raw suppliers

5-Chloro-1,1,1-trifluoro-3-oxapentane ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

Useful:

• Canonical SMILES: C(CCl)OCC(F)(F)F

Technology Process of 2-(2-Chloroethoxy)-1,1,1-trifluoroethane

There total 2 articles about 2-(2-Chloroethoxy)-1,1,1-trifluoroethane 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:

2,4,6-tris(2,2,2-trifluoroethoxy)-1,3,5-triazine (1547-96-2) + 2-chloro-ethanol (107-07-3) → 5-chloro-1,1,1-trifluoro-3-oxapentane (1537-70-8)

Guidance literature:

With toluene-4-sulfonic acid; In acetonitrile; at 20 ℃; for 4h; Green chemistry;

DOI:10.1039/c5ra00618j

Reference yield:

2,2,2-trifluoroethoxyethanol (2358-54-5) → 5-chloro-1,1,1-trifluoro-3-oxapentane (1537-70-8)

Guidance literature:

With phosphorus pentachloride;

Reference yield:

5-chloro-1,1,1-trifluoro-3-oxapentane (1537-70-8) → fluroxene (406-90-6)

Guidance literature:

With propan-1-ol; potassium hydroxide;

upstream raw materials:

2,2,2-trifluoroethoxyethanol

2,4,6-tris(2,2,2-trifluoroethoxy)-1,3,5-triazine

2-chloro-ethanol

Downstream raw materials:

fluroxene