3-Penten-2-one, 1,1,1,3,5,5,5-heptafluoro-4-(trifluoromethyl)-

Base Information

• Chemical Name: 3-Penten-2-one, 1,1,1,3,5,5,5-heptafluoro-4-(trifluoromethyl)-
• CAS No.: 89810-82-2
• Molecular Formula: C6F10O
• DSSTox Substance ID: DTXSID60526478
• Mol file: 89810-82-2.mol

Synonyms:89810-82-2;3-Penten-2-one, 1,1,1,3,5,5,5-heptafluoro-4-(trifluoromethyl)-;DTXSID60526478;1,1,1,3,5,5,5-Heptafluoro-4-(trifluoromethyl)pent-3-en-2-one

Chemical Property of 3-Penten-2-one, 1,1,1,3,5,5,5-heptafluoro-4-(trifluoromethyl)-

Chemical Property:

• XLogP3: 3.9
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 11
• Rotatable Bond Count: 1
• Exact Mass: 277.97894624
• Heavy Atom Count: 17
• Complexity: 323

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

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

Technology Process of 3-Penten-2-one, 1,1,1,3,5,5,5-heptafluoro-4-(trifluoromethyl)-

There total 3 articles about 3-Penten-2-one, 1,1,1,3,5,5,5-heptafluoro-4-(trifluoromethyl)- 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:

perfluoro-4-methyl-2-pentene (2070-70-4) → perfluoro-4-methyl-3-penten-2-one (89810-82-2)

Guidance literature:

Multi-step reaction with 3 steps

1: diethyl ether / 2 h / 0 °C

2: aq. HCl

3: conc. H₂SO₄ / distillation

With hydrogenchloride; sulfuric acid; In diethyl ether;

DOI:10.1007/BF00954714

Reference yield:

perfluoro(methyl isobutenyl ketone)hydrate (89810-81-1) → perfluoro-4-methyl-3-penten-2-one (89810-82-2)

Guidance literature:

With sulfuric acid; Yield given; distillation;

DOI:10.1007/BF00954714

Reference yield:

4-pyrrolidinoperfluoro-2-methyl-2-pentene (89810-72-0) → perfluoro-4-methyl-3-penten-2-one (89810-82-2)

Guidance literature:

Multi-step reaction with 2 steps

1: aq. HCl

2: conc. H₂SO₄ / distillation

With hydrogenchloride; sulfuric acid;

DOI:10.1007/BF00954714

upstream raw materials:

perfluoro(methyl isobutenyl ketone)hydrate

perfluoro-4-methyl-2-pentene

4-pyrrolidinoperfluoro-2-methyl-2-pentene