2-Chloro-2,3,3,3-tetrafluoropropanoic acid

Base Information

• Chemical Name: 2-Chloro-2,3,3,3-tetrafluoropropanoic acid
• CAS No.: 6189-02-2
• Molecular Formula: C3HClF4O2
• Molecular Weight: 180.486
• Hs Code.: 2915900090
• DSSTox Substance ID: DTXSID30476698
• Mol file: 6189-02-2.mol

Synonyms:2-chloro-2,3,3,3-tetrafluoropropanoic acid;6189-02-2;2-CHLOROTETRAFLUOROPROPIONIC ACID;MFCD00465559;SCHEMBL4853439;DTXSID30476698;HHPGRVJNNAIZAR-UHFFFAOYSA-N;AKOS005173378;AT23440;MS-20503;CS-0204974

Chemical Property of 2-Chloro-2,3,3,3-tetrafluoropropanoic acid

Chemical Property:

• Vapor Pressure: 7.09mmHg at 25°C
• Boiling Point: 126.7oC at 760 mmHg
• Flash Point: 30.4oC
• PSA: 37.30000
• Density: 1.703g/cm3
• LogP: 1.53790
• XLogP3: 1.8
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 6
• Rotatable Bond Count: 1
• Exact Mass: 179.9601196
• Heavy Atom Count: 10
• Complexity: 155

Purity/Quality:

95% ^*data from raw suppliers

2-Chlorotetrafluoropropionic acid ^*data from reagent suppliers

Safty Information:

• Hazard Codes: Xi,C

MSDS Files:

SDS file from LookChem

Useful:

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

Technology Process of 2-Chloro-2,3,3,3-tetrafluoropropanoic acid

There total 3 articles about 2-Chloro-2,3,3,3-tetrafluoropropanoic acid 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:

1-bromo-1-chloro-1,2,2,2-tetrafluoro-ethane (754-20-1) + carbon dioxide (124-38-9,18923-20-1) → 2,3,3,3-tetrafluoropropionic acid (359-49-9) + 2-chloro-2,3,3,3-tetrafluoro-propanoic acid (6189-02-2)

Guidance literature:

With water; hydrogen cation; zinc; In N,N-dimethyl-formamide; for 6h; irradiation by ultrasound;

DOI:10.1016/S0022-1139(00)85074-5

Reference yield:

1,2-Dichlorpentafluorpropyl-aethyl-aether (17700-16-2) → 2-chloro-2,3,3,3-tetrafluoro-propanoic acid (6189-02-2)

Guidance literature:

With aluminium trichloride;

Reference yield:

→ 2-chloro-2,3,3,3-tetrafluoro-propanoic acid (6189-02-2)

Guidance literature:

Trifluorchloraethylen, CO2, CsF, Diaethylenglykol-dimethylaether, 50grad;

upstream raw materials:

1,2-Dichlorpentafluorpropyl-aethyl-aether

1-bromo-1-chloro-1,2,2,2-tetrafluoro-ethane

carbon dioxide