1,1,2,3,3-Pentachloropropane

Base Information

• Chemical Name: 1,1,2,3,3-Pentachloropropane
• CAS No.: 15104-61-7
• Molecular Formula: C3H3 Cl5
• Molecular Weight: 216.322
• Hs Code.: 2903199000
• European Community (EC) Number: 630-857-1
• DSSTox Substance ID: DTXSID20164698
• Nikkaji Number: J642D
• Wikidata: Q83033771
• Mol file: 15104-61-7.mol

Synonyms:1,1,2,3,3-PENTACHLOROPROPANE;15104-61-7;Propane, 1,1,2,3,3-pentachloro-;SCHEMBL159954;PANVCEBTPSTUEL-UHFFFAOYSA-;DTXSID20164698;AKOS028108409;LS-120897;CS-0216304;FT-0637182;P0313;EN300-392956

Chemical Property of 1,1,2,3,3-Pentachloropropane

Chemical Property:

• Vapor Pressure: 0.351mmHg at 25°C
• Melting Point: -10 °C
• Refractive Index: 1.5131
• Boiling Point: 205.8°Cat760mmHg
• Flash Point: 79.9°C
• PSA: 0.00000
• Density: 1.589g/cm³
• LogP: 3.20120
• XLogP3: 3
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 0
• Rotatable Bond Count: 2
• Exact Mass: 215.864788
• Heavy Atom Count: 8
• Complexity: 52.7

Purity/Quality:

98%min ^*data from raw suppliers

1,1,2,3,3-Pentachloropropane ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Total 1 MSDS from other Authors

Useful:

• Canonical SMILES: C(C(Cl)Cl)(C(Cl)Cl)Cl

Technology Process of 1,1,2,3,3-Pentachloropropane

There total 15 articles about 1,1,2,3,3-Pentachloropropane 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: 97.0%

1,2-Dichloroethylene (540-59-0,43695-79-0) + chloroform (67-66-3,8013-54-5) → 1,1,2,3,3-pentachloropropane (15104-61-7)

Guidance literature:

With aluminum (III) chloride; at 40 - 80 ℃; for 4h; Reagent/catalyst; Temperature; Concentration; Autoclave;

Reference yield: 19.4%

→ 1,2,2-trichloropropane (3175-23-3) + 1,1,2,2-tetrachloropropane (13116-60-4) + 1,2,3-trichloropropane (96-18-4) + 1,2,2,3-tetrachloropropane (13116-53-5) + 1,1,2,3-tetrachloropropane (18495-30-2) + 1,1,1,2,2-pentachloropropane (64240-29-5) + 1,1,1,2,3-pentachloro-propane (21700-31-2) + 1,1,2,3,3-pentachloropropane (15104-61-7) + 1,1,2,2,3-pentachloropropane (16714-68-4)

Guidance literature:

With sulfuryl dichloride; 2,2'-azobis(isobutyronitrile); at 55 - 60 ℃;

Reference yield: 14.79%

1,1,2,3-tetrachloropropane (18495-30-2) → 1,1,1,2,3-pentachloro-propane (21700-31-2) + 1,1,2,3,3-pentachloropropane (15104-61-7) + 1,1,2,2,3-pentachloropropane (16714-68-4)

Guidance literature:

With dimethyl 2,2'-azobis(isobutyrate); chlorine; In tetrachloromethane; at 70 ℃; for 2.08333h; under 8517.48 Torr; Time; Sealed tube;

upstream raw materials:

1,2-Dichloroethylene

chloroform

trans-1,2-dichloroethylene

cis-1,2-Dichloroethylene

Downstream raw materials:

1,2,3,3-tetrachloro-1-propene

trans-1,2,3,3-tetrachloropropene

Refernces

• 1、 -. "Preparation method of 1,1,2,3-tetrachloropropene". Paragraph 0031; 0036; 0041; 0046; 0051; 0056. . Retrieved 2017/11/04.
• 2、 -. "PROCESS FOR THE PRODUCTION OF CHLORINATED PROPENES". Paragraph 0071; 0072. . Retrieved 2013/03/26.