1,1,2,2,3,3,4,4,5,6-Decafluoro-5,6-bis(trifluoromethyl)cyclohexane

Base Information

• Chemical Name: 1,1,2,2,3,3,4,4,5,6-Decafluoro-5,6-bis(trifluoromethyl)cyclohexane
• CAS No.: 306-98-9
• Molecular Formula: C8F16
• Molecular Weight: 400.062
• Hs Code.: 2903890090
• European Community (EC) Number: 206-195-0
• DSSTox Substance ID: DTXSID20870500
• Nikkaji Number: J191.429D
• Mol file: 306-98-9.mol

Synonyms:Perfluoro-1,2-dimethylcyclohexane;306-98-9;1,1,2,2,3,3,4,4,5,6-Decafluoro-5,6-bis(trifluoromethyl)cyclohexane;EINECS 206-195-0;Cyclohexane, 1,1,2,2,3,3,4,4,5,6-decafluoro-5,6-bis(trifluoromethyl)-;SCHEMBL196722;DTXSID20870500;perfluoro(1,2-dimethylcyclohexane);perfluoro-1,2-dimethyl-cyclohexane;MFCD00066612;AKOS015853382;PERFLUORO-(1,2-DIMETHYLCYCLOHEXANE);FT-0626960;J-018072;1,2-Di(trifluoromethyl)-1,2,3,3,4,4,5,5,6,6-decafluorocyclohexane

Chemical Property of 1,1,2,2,3,3,4,4,5,6-Decafluoro-5,6-bis(trifluoromethyl)cyclohexane

Chemical Property:

• Appearance/Colour: Clear colourless odourless liquid
• Vapor Pressure: 40.5mmHg at 25°C
• Melting Point: -70 °C
• Refractive Index: 1.292
• Boiling Point: 101.5 °C at 760 mmHg
• Flash Point: 14.2 °C
• PSA: 0.00000
• Density: 1.75 g/cm³
• LogP: 5.08240
• XLogP3: 5.4
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 16
• Rotatable Bond Count: 0
• Exact Mass: 399.9744506
• Heavy Atom Count: 24
• Complexity: 475

Purity/Quality:

98%,99%, ^*data from raw suppliers

Perfluoro-1,2-dimethylcyclohexane ^*data from reagent suppliers

Safty Information:

• Pictogram(s): F,Xi
• Hazard Codes: F,Xi
• Statements: 11-36/37/38
• Safety Statements: 16-26-33-36

MSDS Files:

SDS file from LookChem

Total 1 MSDS from other Authors

Useful:

• Chemical Classes: Other Classes -> Halogenated Cyclic Hydrocarbons
• Canonical SMILES: C1(C(C(C(C(C1(F)F)(F)F)(F)F)(F)F)(C(F)(F)F)F)(C(F)(F)F)F
• Uses: Perfluoro-1,2-dimethylcyclohexane is used in method for manufacturing surface nanoprotrusion structure using polymer stamp with colloidal particles.

Technology Process of 1,1,2,2,3,3,4,4,5,6-Decafluoro-5,6-bis(trifluoromethyl)cyclohexane

There total 5 articles about 1,1,2,2,3,3,4,4,5,6-Decafluoro-5,6-bis(trifluoromethyl)cyclohexane 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:

o-xylene (95-47-6) → perfluoro(methylcyclohexane) (355-02-2) + 1,2-bis(trifluoromethyl)decafluorocyclohexane (306-98-9)

Guidance literature:

at 200 - 300 ℃; Leiten ueber CoF₃;

DOI:10.1021/ie50447a618 DOI:10.1053/ajkd.2001.26839

Reference yield:

→ 1,2-bis(trifluoromethyl)decafluorocyclohexane (306-98-9)

Guidance literature:

With cobalt (III) fluoride; nitrogen; at 200 - 300 ℃;

DOI:10.1021/ie50447a618 DOI:10.1053/ajkd.2001.26839

Reference yield:

1,2-bis(trifluoromethyl)-3,3,4,4,5,5,6,6-octafluorocyclohexene (10534-39-1) → 1,2-bis(trifluoromethyl)decafluorocyclohexane (306-98-9)

Guidance literature:

Multi-step reaction with 2 steps

1: 5.0 g / hydrogen / palladium-charcoal / 24 h / 16 °C / 76000 Torr

2: cobalt(III) fluoride / 215 °C

With cobalt(III) fluoride; hydrogen; palladium on activated charcoal;

DOI:10.1016/S0022-1139(00)81941-7

upstream raw materials:

iodotrifluoromethane

decafluorocyclohex-1-ene

cis 1H,2H/1,2-bis(trifluoromethyl)octafluorocyclohexane

o-xylene

Refernces