Iodocyclohexane

Base Information

• Chemical Name: Iodocyclohexane
• CAS No.: 626-62-0
• Molecular Formula: C6H11I
• Molecular Weight: 210.058
• Hs Code.: 29038900
• European Community (EC) Number: 210-957-8
• NSC Number: 6075
• DSSTox Substance ID: DTXSID3060821
• Nikkaji Number: J43.523F
• Wikidata: Q15726066
• Mol file: 626-62-0.mol

Synonyms:IODOCYCLOHEXANE;626-62-0;Cyclohexyl iodide;Cyclohexane, iodo-;Cyclohexyliodide;c-C6H11I;Iodocyclohexane, stab. with copper;NSC 6075;EINECS 210-957-8;iodo-cyclohexane;1-iodocyclohexane;NSC6075;MFCD00003826;Heptynyltrimethylsilane;Iodocyclohexane, 98%;SCHEMBL73820;C6H11I;DTXSID3060821;Iodocyclohexane stabilized over Cu;C6-H11-I;NSC-6075;STL183316;AKOS000118786;AS-56637;BP-21170;CS-0148628;FT-0627261;I0056;EN300-19417;F20359;A868407;J-802178;J-802225;F2190-0186

Chemical Property of Iodocyclohexane

Chemical Property:

• Appearance/Colour: clear slight brown liquid
• Vapor Pressure: 0.754mmHg at 25°C
• Melting Point: 52℃
• Refractive Index: n20/D 1.5441(lit.)
• Boiling Point: 190.3 °C at 760 mmHg
• Flash Point: 71.7 °C
• Density: 1.62 g/cm³
• Storage Temp.: 0-6°C
• Sensitive.: Light Sensitive
• Solubility.: Soluble in ethanol, ether, acetone.
• XLogP3: 3.8
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 0
• Rotatable Bond Count: 0
• Exact Mass: 209.99055
• Heavy Atom Count: 7
• Complexity: 46.1

Purity/Quality:

98% ^*data from raw suppliers

Iodocyclohexane (stabilized with Copper chip) >98.0%(GC) ^*data from reagent suppliers

Safty Information:

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

MSDS Files:

SDS file from LookChem

Total 1 MSDS from other Authors

Useful:

• Chemical Classes: Other Classes -> Halogenated Cyclic Hydrocarbons
• Canonical SMILES: C1CCC(CC1)I
• Uses: Iodocyclohexane has been employed as reagent in demethylation of aryl methyl ethers in DMF under reflux condition.

Technology Process of Iodocyclohexane

There total 67 articles about Iodocyclohexane 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: 100.0%

cyclohexane-1,2-epoxide (286-20-4) → Cyclohexyl iodide (626-62-0)

Guidance literature:

With 1,1,3,3-Tetramethyldisiloxane; iodine; In dichloromethane; 1.) -5 deg C, 2.) room temperature, 10 min;

DOI:10.1016/S0040-4020(01)82361-9

Reference yield: 99.0%

cyclohexanol (108-93-0) → Cyclohexyl iodide (626-62-0)

Guidance literature:

With trimethylsilylphosphate; sodium iodide; for 10h; Ambient temperature;

DOI:10.1055/s-1983-30378

Reference yield: 95.0%

cyclohexene (110-83-8) → Cyclohexyl iodide (626-62-0)

Guidance literature:

With triethylsilane; tetrafluoroboric acid; iodine; copper(II) oxide; In dichloromethane; for 3h; Ambient temperature;

upstream raw materials:

cyclohexyl chloride

dicyclohexyl ether

cyclohexene

cyclohexanol

Downstream raw materials:

octadecylcyclohexane

(9-cyclohexyl-fluoren-9-yl)-phenyl ketone

cyano(cyclohexyl)acetic acid ethyl ester

4-cyclohexyl-butan-2-one

Refernces

• 1、 Yue, Fuyang,Dong, Jianyang,Liu, Yuxiu,Wang, Qingmin. "Visible-Light-Mediated C-I Difluoroallylation with an α-Aminoalkyl Radical as a Mediator". supporting information. p. 7306 - 7310. Retrieved 2021/10/01.
• 2、 Chen, Weiqiang,Walker, Johannes C. L.,Oestreich, Martin. "Metal-Free Transfer Hydroiodination of C-C Multiple Bonds". supporting information. p. 1135 - 1140. Retrieved 2019/01/11.