Chlorodifluoroacetaldehyde

Base Information

• Chemical Name: Chlorodifluoroacetaldehyde
• CAS No.: 811-96-1
• Molecular Formula: C2H Cl F2 O
• Molecular Weight: 114.479
• European Community (EC) Number: 212-376-5
• DSSTox Substance ID: DTXSID3073929
• Nikkaji Number: J100.999K
• Wikidata: Q82002498
• Mol file: 811-96-1.mol

Synonyms:chlorodifluoroacetaldehyde

Chemical Property of Chlorodifluoroacetaldehyde

Chemical Property:

• PSA: 17.07000
• LogP: 1.01690
• XLogP3: 1.1
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 1
• Exact Mass: 113.9683987
• Heavy Atom Count: 6
• Complexity: 62.6

Purity/Quality:

99% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C(=O)C(F)(F)Cl

Technology Process of Chlorodifluoroacetaldehyde

There total 3 articles about Chlorodifluoroacetaldehyde 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-Chloro-1,1-difluoroethane (75-68-3) → formaldehyd (50-00-0,30525-89-4,61233-19-0) + Chlorodifluoroacetaldehyde (811-96-1) + chlorodifluoromethyl (1691-89-0) + 1-Chloro-1,1-difluoro-2-nitrosooxy-ethane

Guidance literature:

With oxygen; nitrogen(II) oxide; chlorine; at 19.9 ℃; under 37.5 Torr; Rate constant; Thermodynamic data; Product distribution; Irradiation; ΔH_R, var. of ratios;

Reference yield:

ethyl 2-chloro-2,2-difluoroacetate (383-62-0) → Chlorodifluoroacetaldehyde (811-96-1)

Guidance literature:

With diisobutylaluminium hydride; In tetrahydrofuran; dichloromethane; at -78 ℃; for 0.5h; Inert atmosphere;

Reference yield:

chlordifluoroacetyl chloride (354-24-5) → Chlorodifluoroacetaldehyde (811-96-1)

Guidance literature:

With palladium on activated charcoal; at 150 ℃; Hydrogenation;

upstream raw materials:

chlordifluoroacetyl chloride

1-Chloro-1,1-difluoroethane

ethyl 2-chloro-2,2-difluoroacetate

Downstream raw materials:

1-chloro-1,1-difluoro-2,2-diphenyl-ethane