1,3,3-Trichloro-1,1-difluoropropane

Base Information

• Chemical Name: 1,3,3-Trichloro-1,1-difluoropropane
• CAS No.: 460-63-9
• Molecular Formula: C3H3 Cl3 F2
• Molecular Weight: 183.413
• Hs Code.: 2903791090
• DSSTox Substance ID: DTXSID90196683
• Wikidata: Q83069704
• Mol file: 460-63-9.mol

Synonyms:1,3,3-Trichloro-1,1-difluoropropane;460-63-9;1,1-Difluoro-1,3,3-trichloropropane;C3H3Cl3F2;Propane, 1,3,3-trichloro-1,1-difluoro-;HCFC-242fa;SCHEMBL819657;DTXSID90196683;MFCD02093297;AKOS006228632;FT-0694684

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

Chemical Property:

• Vapor Pressure: 23.1mmHg at 25°C
• Boiling Point: 114.9°Cat760mmHg
• Flash Point: 24.8°C
• PSA: 0.00000
• Density: 1.484g/cm³
• LogP: 3.01180
• XLogP3: 3.3
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 2
• Exact Mass: 181.926840
• Heavy Atom Count: 8
• Complexity: 72.9

Purity/Quality:

98%Min ^*data from raw suppliers

1,3,3-Trichloro-1,1-difluoropropane 97% ^*data from reagent suppliers

Safty Information:

• Hazard Codes: Xi

MSDS Files:

SDS file from LookChem

Useful:

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

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

There total 7 articles about 1,3,3-Trichloro-1,1-difluoropropane 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: 7.8%

1,1,1,3,3-pentachloropropane (23153-23-3) → 1-chloro-1,3,3,3-tetrafluoropropane (149329-29-3) + 1,3-dichloro-3,3-difluoroprop-1-ene + 1,1,3,3-tetrachloro-1-fluoropropane + 1,1-dichloro-3,3,3-trifluoropropane (460-69-5) + 1,1,3-trichloro-3,3-difluoropropane (460-63-9) + 1,1,1,3,3-Pentafluoropropane (460-73-1) + 1-chloro-3,3,3-trifluoropropene (2730-43-0)

Guidance literature:

With hydrogen fluoride; In sulfolane; at 100 ℃; for 3h; under 14480.5 Torr;

Reference yield:

1,1,1,3,3-pentachloropropane (23153-23-3) → 1-chloro-1,3,3,3-tetrafluoropropane (149329-29-3) + 1,1-dichloro-3,3,3-trifluoropropane (460-69-5) + 1,1,3-trichloro-3,3-difluoropropane (460-63-9) + trans-1-chloro-3,3,3-trifluoropropene (102687-65-0)

Guidance literature:

1,1,1,3,3-pentachloropropane; With hydrogen fluoride; at 100 - 150 ℃; for 24h; under 30003 Torr;

With chlorine; at 150 ℃; for 0.0144444h;

Reference yield:

1,1,1,3,3-pentachloropropane (23153-23-3) → 1,1,3-trichloro-3,3-difluoropropane (460-63-9) + (Z)-1-chloro-3,3,3-trifluoro-1-propene (99728-16-2) + trans-1-chloro-3,3,3-trifluoropropene (102687-65-0)

Guidance literature:

With hydrogen fluoride; chlorine; at 320 ℃; for 0.0138889h; Inert atmosphere;

upstream raw materials:

1-chloro-1,1-difluoro-propane

chlorine

1,1,1,3,3-pentachloropropane

Downstream raw materials:

(Z)-1-chloro-3,3,3-trifluoro-1-propene

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

trans-1-chloro-3,3,3-trifluoropropene

trans-1,3,3,3-tetrafluoropropene

Refernces

• 1、 -. "METHOD FOR PRODUCING TRANS-1-CHLORO-3,3,3-TRIFLUOROPROPENE". Paragraph 0102. . Retrieved 2017/05/15.