Perfluoro(3-isopropyl-4-methyl-2-pentene)

Base Information

• Chemical Name: Perfluoro(3-isopropyl-4-methyl-2-pentene)
• CAS No.: 30320-27-5
• Molecular Formula: C9F18
• Molecular Weight: 450.07
• European Community (EC) Number: 250-130-9
• DSSTox Substance ID: DTXSID70880250
• Nikkaji Number: J28.300B
• Mol file: 30320-27-5.mol

Synonyms:30320-27-5;Perfluoro(3-isopropyl-4-methyl-2-pentene);SCHEMBL6130500;DTXSID70880250;perfluoro-3-isopropyl-4-methyl-2-pentene;NS00018907;perfluoro-(4-methyl-3-isopropyl-2-pentene)

Chemical Property of Perfluoro(3-isopropyl-4-methyl-2-pentene)

Chemical Property:

• Vapor Pressure: 11.3mmHg at 25°C
• Boiling Point: 141.6°Cat760mmHg
• Flash Point: 46.4°C
• PSA: 0.00000
• Density: 1.674g/cm³
• LogP: 6.43810
• XLogP3: 6.4
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 18
• Rotatable Bond Count: 2
• Exact Mass: 449.9712569
• Heavy Atom Count: 27
• Complexity: 504

Purity/Quality:

99% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

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

Technology Process of Perfluoro(3-isopropyl-4-methyl-2-pentene)

There total 11 articles about Perfluoro(3-isopropyl-4-methyl-2-pentene) 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: 90.0%

perfluoropropylene (116-15-4,13429-24-8,25120-07-4,6792-31-0) → perfluoro(4-methyl-3-isopropyl-2-pentene) (30320-27-5)

Guidance literature:

With cesium fluoride; In acetonitrile; at 50 ℃; for 1h; under 6000.6 Torr;

DOI:10.1016/j.jfluchem.2013.08.007

Reference yield:

perfluoropropylene (116-15-4,13429-24-8,25120-07-4,6792-31-0) → perfluoro-2-methylpent-2-ene (1584-03-8) + trans-perfluoro-(4-methyl-2-pentene) (3709-71-5) + perfluoro(4-methyl-3-isopropyl-2-pentene) (30320-27-5) + 1,1,1,4,5,5,5-heptafluoro-3-(pentafluoroethyl)-2,4-bis(trifluoromethyl)pent-2-ene (30320-26-4) + 2, 4, 5 - Tri(trifluoromethyl) - n - nonafluorohexen(2) (2107-26-8) + 2, 3, 5 - Tri(trifluoromethyl) - n - nonafluorohexen(2) (2107-25-7)

Guidance literature:

With bis(benzene)chromium⁽⁰⁾; In benzene; for 24h; Product distribution; Mechanism; other solvent;

DOI:10.1016/S0022-328X(00)81475-8

Reference yield:

perfluoropropylene (116-15-4,13429-24-8,25120-07-4,6792-31-0) → perfluoro-2-methylpent-2-ene (1584-03-8) + trans-perfluoro-(4-methyl-2-pentene) (3709-71-5) + perfluoro(4-methyl-3-isopropyl-2-pentene) (30320-27-5) + 1,1,1,4,5,5,5-heptafluoro-3-(pentafluoroethyl)-2,4-bis(trifluoromethyl)pent-2-ene (30320-26-4) + (E)-1,1,4,5,5,5-Hexafluoro-3-(1,2,2,2-tetrafluoro-1-trifluoromethyl-ethyl)-2-trifluoromethyl-penta-1,3-diene + 1,1,5,5,5-Pentafluoro-3-pentafluoroethyl-2,4-bis-trifluoromethyl-penta-1,3-diene

Guidance literature:

With ?-bis(biphenyl)chromium(0); Product distribution; var. catalysts;

DOI:10.1016/S0022-328X(00)86098-2

upstream raw materials:

perfluoropropylene

perfluoro-2,4-dimethyl-3-ethylpent-3-yl radical

1,1,1,4,5,5,5-heptafluoro-3-(pentafluoroethyl)-2,4-bis(trifluoromethyl)pent-2-ene

(trifluoromethyl)trimethylsilane

Downstream raw materials:

perfluoro-2,4-dimethyl-3-ethylpentane

perfluoro-3-ethyl-2,4-dimethylpent-1-ene

perfluoro-2-isopropyl-3,3-dimethylbut-1-ene

1,1,1,4,5,5,5-heptafluoro-3-(pentafluoroethyl)-2,4-bis(trifluoromethyl)pent-2-ene