1,1,1,2,2,3,3-Heptafluoro-5-iodononane

Base Information

• Chemical Name: 1,1,1,2,2,3,3-Heptafluoro-5-iodononane
• CAS No.: 755-48-6
• Molecular Formula: C₉H₁₂F₇I
• Molecular Weight: 380.088
• Hs Code.: 2903779090
• DSSTox Substance ID: DTXSID90404578
• Nikkaji Number: J619.174F
• Mol file: 755-48-6.mol

Synonyms:1,1,1,2,2,3,3-heptafluoro-5-iodononane;755-48-6;5,7-OCTADECADIYNOICACID;DTXSID90404578;MFCD00155833;AKOS015852809;FT-0632898;NS00111920

Chemical Property of 1,1,1,2,2,3,3-Heptafluoro-5-iodononane

Chemical Property:

• Vapor Pressure: 0.213mmHg at 25°C
• Refractive Index: 1.4040 (20℃)
• Boiling Point: 85°C 23mm
• Flash Point: 92.1°C
• PSA: 0.00000
• Density: 1.3826 g/cm3 (20℃)
• LogP: 5.20320
• XLogP3: 6.2
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 7
• Rotatable Bond Count: 6
• Exact Mass: 379.98720
• Heavy Atom Count: 17
• Complexity: 236

Purity/Quality:

99%, ^*data from raw suppliers

1,1,1,2,2,3,3-Heptafluoro-5-iodononane ^*data from reagent suppliers

Safty Information:

• Hazard Codes: Xi
• Statements: 36/37/38
• Safety Statements: 26-36

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCCCC(CC(C(C(F)(F)F)(F)F)(F)F)I

Technology Process of 1,1,1,2,2,3,3-Heptafluoro-5-iodononane

There total 2 articles about 1,1,1,2,2,3,3-Heptafluoro-5-iodononane 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: 60.0%

1-hexene (592-41-6,25067-06-5) + 1,1,1,2,2,3,3-heptafluoro-3-iodo-propane (754-34-7) → 1-(n-perfluoropropyl)-2-iodohexane (755-48-6)

Guidance literature:

titanium tetrachloride; zinc; In 1,2-dimethoxyethane; at 70 ℃; for 30h;

DOI:10.1016/0022-1139(94)03102-6

Reference yield:

→ 1-(n-perfluoropropyl)-2-iodohexane (755-48-6)

Guidance literature:

d. Olefin, RI;

Reference yield:

1-(n-perfluoropropyl)-2-iodohexane (755-48-6) + tributylstannylethynylbenzene (3757-88-8) → (3-Butyl-5,5,6,6,7,7,7-heptafluoro-hept-1-ynyl)-benzene

Guidance literature:

With tetrakis(triphenylphosphine) palladium⁽⁰⁾; In benzene; at 120 ℃; for 16h;

DOI:10.1016/0040-4039(96)01922-3

upstream raw materials:

1-hexene

1,1,1,2,2,3,3-heptafluoro-3-iodo-propane

Downstream raw materials:

(E)-u.(Z)-1,1,1,2,2,3,3-Heptafluornon-4-en

(E)-1,1,1,2,2,3,3-Heptafluornon-4-en

1,1,1,2,2,3,3-heptafluoro-non-4c-ene

(E)-7,7,8,8,9,9,9-Heptafluoro-non-4-ene

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