5-Iodo-1,1,1-trifluoropentane

Base Information

• Chemical Name: 5-Iodo-1,1,1-trifluoropentane
• CAS No.: 352-60-3
• Molecular Formula: C5H8F3I
• Molecular Weight: 252.018
• Hs Code.: 2903799090
• DSSTox Substance ID: DTXSID00377820
• Nikkaji Number: J2.335.297D
• Wikidata: Q82167177
• Mol file: 352-60-3.mol

Synonyms:5-Iodo-1,1,1-trifluoropentane;352-60-3;1,1,1-trifluoro-5-iodopentane;MFCD06247810;SCHEMBL253215;5,5,5-Trifluoropentyl iodide;5-Jod-1,1,1-trifluorpentan;Boc-L-glutamicacid?-allylester;DTXSID00377820;MEEXEEFLZJDBEV-UHFFFAOYSA-N;AKOS015853769;FT-0677373

Chemical Property of 5-Iodo-1,1,1-trifluoropentane

Chemical Property:

• Refractive Index: 1.439 (589.3 nm 17℃)
• Boiling Point: 153℃
• PSA: 0.00000
• Density: 1.722±0.06 g/cm3(Predicted)
• LogP: 3.15400
• XLogP3: 3.9
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 3
• Exact Mass: 251.96228
• Heavy Atom Count: 9
• Complexity: 69.1

Purity/Quality:

98%min ^*data from raw suppliers

1,1,1-Trifluoro-5-iodopentane 95% ^*data from reagent suppliers

Safty Information:

• Hazard Codes: Xi

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C(CCI)CC(F)(F)F

Technology Process of 5-Iodo-1,1,1-trifluoropentane

There total 2 articles about 5-Iodo-1,1,1-trifluoropentane 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:

ethene (74-85-1) + iodotrifluoromethane (2314-97-8,263005-66-9) → 1,1,1-trifluoro-3-iodopropane (460-37-7,71215-70-8) + 1,1,1-trifluoropropane (421-07-8) + 5-iodo-1,1,1-trifluoropentane (352-60-3)

Guidance literature:

je nach den Bedingungen;

Reference yield:

ethene (74-85-1) + iodotrifluoromethane (2314-97-8,263005-66-9) → 1,1,1-trifluoro-3-iodopropane (460-37-7,71215-70-8) + 1,1,1-trifluoropropane (421-07-8) + 5-iodo-1,1,1-trifluoropentane (352-60-3)

Guidance literature:

je nach den Bedingungen;

Reference yield: 77.0%

5-iodo-1,1,1-trifluoropentane (352-60-3) + benzaldehyde (100-52-7) → 1-phenyl-6,6,6-trifluoro-1-hexanol (1245716-73-7)

Guidance literature:

5-iodo-1,1,1-trifluoropentane; With iodine; magnesium; In diethyl ether; at 20 ℃; for 0.833333h; Inert atmosphere;

benzaldehyde; In diethyl ether; at 20 ℃; Inert atmosphere; Cooling with ice;

DOI:10.1039/c001561j

upstream raw materials:

ethene

iodotrifluoromethane

Downstream raw materials:

1-phenyl-6,6,6-trifluoro-1-hexanol