1,1,3-Trichloro-1-fluoropropane

Base Information

• Chemical Name: 1,1,3-Trichloro-1-fluoropropane
• CAS No.: 818-99-5
• Molecular Formula: C3H4Cl3F
• Molecular Weight: 165.42100
• DSSTox Substance ID: DTXSID40382175
• Wikidata: Q82173495
• Mol file: 818-99-5.mol

Synonyms:818-99-5;1,1,3-trichloro-1-fluoropropane;1-FLUORO-1,1,3-TRICHLOROPROPANE;HCFC-251fb;SCHEMBL766023;DTXSID40382175;MFCD00082624;AKOS006384028;LS-121094;1,1,3-tris(chloranyl)-1-fluoranyl-propane;FT-0690766;A840214

Chemical Property of 1,1,3-Trichloro-1-fluoropropane

Chemical Property:

• Vapor Pressure: 16.4mmHg at 25°C
• Boiling Point: 119oC
• Flash Point: 28.6oC
• PSA: 0.00000
• Density: 1.405g/cm3
• LogP: 2.71620
• XLogP3: 2.8
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 2
• Exact Mass: 163.936261
• Heavy Atom Count: 7
• Complexity: 54.1

Purity/Quality:

99% ^*data from raw suppliers

1-Fluoro-1,1,3-trichloropropane 97% ^*data from reagent suppliers

Safty Information:

• Pictogram(s): Xi
• Hazard Codes: Xi

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C(CCl)C(F)(Cl)Cl

Technology Process of 1,1,3-Trichloro-1-fluoropropane

There total 4 articles about 1,1,3-Trichloro-1-fluoropropane 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: 51.0%

1,1,1,3-tetrachloropropane (1070-78-6) → 1,1-difluoro-1,3-dichloropropane (819-00-1) + 1-Fluor-1,1,3-trichlor-propan (818-99-5) + 1,1-Dichloro-1,3-difluoro-propane (121612-64-4)

Guidance literature:

With bromine trifluoride; tin(IV) chloride; In 1,1,2-Trichloro-1,2,2-trifluoroethane; at 20 - 25 ℃;

Reference yield:

1,1,1,3-tetrachloropropane (1070-78-6) → 1-Fluor-1,1,3-trichlor-propan (818-99-5)

Guidance literature:

With antimonypentachloride; antimony(III) fluoride; Heating;

DOI:10.1007/BF00912259

Reference yield:

ethene (74-85-1) + trichlorofluoromethane (75-69-4) → 1-Fluor-1,1,3-trichlor-propan (818-99-5)

Guidance literature:

With 2,2'-azobis(isobutyronitrile); (telomerisation);

upstream raw materials:

ethene

trichlorofluoromethane

1,1,1,3-tetrachloropropane

Refernces

• 1、 Chuvatkin, N. N.,Panteleeva, I. Yu.,Boguslavskaya, L. S.. "REACTIONS OF CHLORINE MONOFLUORIDE. SUBSTITUTION OF CHLORINE ATOMS BY FLUORINE IN CHLORINE-SUBSTITUTED ALKANES AND ESTERS". . p. 821 - 827. Retrieved 2007/10/02.