1,1,1-Trifluoro-2-iodoethane

Base Information

• Chemical Name: 1,1,1-Trifluoro-2-iodoethane
• CAS No.: 353-83-3
• Molecular Formula: C2H2F3I
• Molecular Weight: 209.938
• Hs Code.: 29037990
• European Community (EC) Number: 206-541-0
• UNII: CA0J38WE9Z
• DSSTox Substance ID: DTXSID80188810
• Nikkaji Number: J149.904A
• Wikidata: Q27275372
• Mol file: 353-83-3.mol

Synonyms:1,1,1-trifluoro-2-iodoethane

Chemical Property of 1,1,1-Trifluoro-2-iodoethane

Chemical Property:

• Appearance/Colour: clear colorless to pink liquid
• Vapor Pressure: 3.96 psi ( 20 °C)
• Refractive Index: n20/D 1.401(lit.)
• Boiling Point: 53.7 °C at 760 mmHg
• Flash Point: 7.4 °C
• PSA: 0.00000
• Density: 2.169 g/cm³
• LogP: 1.98370
• Storage Temp.: Keep Cold
• Sensitive.: Light Sensitive
• Solubility.: Chloroform
• Water Solubility.: Insoluble
• XLogP3: 2.4
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 0
• Exact Mass: 209.91533
• Heavy Atom Count: 6
• Complexity: 38.5

Purity/Quality:

99% ^*data from raw suppliers

1,1,1-Trifluoro-2-iodoethane ^*data from reagent suppliers

Safty Information:

• Pictogram(s): Xi
• Hazard Codes: Xi
• Statements: 36/37/38
• Safety Statements: 26-36-37/39

MSDS Files:

SDS file from LookChem

Total 1 MSDS from other Authors

Useful:

• Canonical SMILES: C(C(F)(F)F)I
• Uses: 1,1,1-Trifluoro-2-iodoethane (cas# 353-83-3) is a compound useful in organic synthesis.

Technology Process of 1,1,1-Trifluoro-2-iodoethane

There total 16 articles about 1,1,1-Trifluoro-2-iodoethane 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: 58.0%

1-styrenyloxytrimethylsilane (13735-81-4) + 1-[hydroxy(tosyloxy)iodo]-1H,1H-perfluoroethane (166903-46-4) → 1,1,1-trifluoro-2-iodoethane (353-83-3) + 1-phenyl-2-(p-tolylsulfonyloxy)ethanone (7257-94-5)

Guidance literature:

In dichloromethane; for 1h; Ambient temperature;

DOI:10.1016/0040-4039(95)00275-H

Reference yield: 56.0%

1-(Trimethylsilyloxy)cyclohexene (6651-36-1) + 1-[hydroxy(tosyloxy)iodo]-1H,1H-perfluoroethane (166903-46-4) → 1,1,1-trifluoro-2-iodoethane (353-83-3) + 2-(tosyloxy)cyclohexanone (81447-34-9)

Guidance literature:

In dichloromethane; at 0 ℃; for 3h;

DOI:10.1016/0040-4039(95)00275-H

Reference yield: 36.0%

1,1,1-trifluoro-2-chloroethane (75-88-7) → 1,1,1-trifluoro-2-iodoethane (353-83-3)

Guidance literature:

With potassium bromide; at 300 ℃; for 0.333333h;

upstream raw materials:

tris(2,2,2-trifluoroethyl) phosphate

1-bromo-1,1-difluoro-2-iodoethane

2,2,2-trifluorodiazoethane

2,2,2-Trifluoroethyl p-toluenesulfonate

Downstream raw materials:

2,2,2-trifluoroethyl phenyl sulfide

Vinylidene fluoride

(2,2,2-trifluoroethyl)benzene

1-phenyl-3-trifluoromethyl prop-1-ene

Refernces

• 1、 Krogh et al.. "-". . p. 1124. Retrieved 1954.
• 2、 Gilman,Jones. "-". . p. 2038. Retrieved 1943.
• 3、 Zhdankin, Viktor V.,Kuehl, Chris J.,Simonsen, Angela J.. "1-[Hydroxy(sulfonyloxy)iodo]-2,2,2-trifluoroethanes, CF3CH2I(OH)OSO2R: Stable, fluoroalkyl analogs of Koser's reagent". . p. 2203 - 2206. Retrieved 2007/10/02.