Iodocyclopentane

Base Information

• Chemical Name: Iodocyclopentane
• CAS No.: 1556-18-9
• Molecular Formula: C5H9 I
• Molecular Weight: 196.031
• Hs Code.: 29038900
• European Community (EC) Number: 216-311-1
• NSC Number: 6071
• DSSTox Substance ID: DTXSID2061775
• Nikkaji Number: J133.548K
• Wikidata: Q81989661
• Mol file: 1556-18-9.mol

Synonyms:Iodocyclopentane;1556-18-9;Cyclopentane, iodo-;Cyclopentyl iodide;Iodocyclopentane (stabilised with copper);iodo-cyclopentane;NSC 6071;EINECS 216-311-1;MFCD00039446;Jodcyclopentan;Cyclopentyliodide;iodocyclo-pentane;NSC6071;Iodocyclopentane, 97%;SCHEMBL172712;DTXSID2061775;AMY3844;C5-H9-I;BAA55618;NSC-6071;BBL103901;STL557711;AKOS005256987;FS-4099;PB46975;SB12745;Iodocyclopentane, stabilized with copper;SY019127;CS-0067150;FT-0627262;EN300-93401;P10039;J-802181;F0001-0550

Chemical Property of Iodocyclopentane

Chemical Property:

• Vapor Pressure: 0.00642mmHg at 25°C
• Melting Point: 166.5°C
• Refractive Index: n20/D 1.549(lit.)
• Boiling Point: 166.5°Cat760mmHg
• Flash Point: 66.7°C
• PSA: 0.00000
• Density: 1.73g/cm³
• LogP: 2.36400
• Sensitive.: Light Sensitive
• XLogP3: 3.6
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 0
• Rotatable Bond Count: 0
• Exact Mass: 195.97490
• Heavy Atom Count: 6
• Complexity: 37.2

Purity/Quality:

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

Iodocyclopentane 97% ^*data from reagent suppliers

Safty Information:

• Pictogram(s): R36/37/38:Irritating to eyes, respiratory system and skin.
• Hazard Codes: R36/37/38:Irritating to eyes, respiratory system and skin.
• Statements: 10-36/37/38
• Safety Statements: 16-37-6

MSDS Files:

SDS file from LookChem

Total 1 MSDS from other Authors

Useful:

• Canonical SMILES: C1CCC(C1)I
• Uses: Iodocyclopentane may be used in the synthesis of 4-chloro-3′-((2-cyclopentyl-1-oxo-1,2,3,4-tetrahydroisoquinolin-6- yloxy)methyl)biphenyl-3-carboxylic acid and N-(3-methoxyphenethyl)cyclopentanamine.

Technology Process of Iodocyclopentane

There total 17 articles about Iodocyclopentane 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: 92.0%

Cyclopentane (287-92-3) → cyclopentyl iodide (1556-18-9)

Guidance literature:

With sodium hydroxide; iodoform; at 25 ℃; for 16h;

DOI:10.1002/(SICI)1521-3773(19990917)38:18<2786::AID-ANIE2786>3.0.CO;2-0

Reference yield: 90.0%

Cyclopentene oxide (285-67-6) → cyclopentyl iodide (1556-18-9)

Guidance literature:

With 1,1,3,3-Tetramethyldisiloxane; iodine; In dichloromethane; 1.) -5 deg C, 2.) room temperature, 12 min;

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

Reference yield: 82.0%

Cyclopentanol (96-41-3) → cyclopentyl iodide (1556-18-9)

Guidance literature:

With n-pentylmethylimidazolium bromide; tert-Butyl iodide; for 1.5h; sonication;

DOI:10.1002/ejoc.200400597

upstream raw materials:

Cyclopentyl bromide

Cyclopentanol

cyclobutanemethanol

cyclopentyl tosylate

Downstream raw materials:

diethyl 2-cyclopentylmalonate

cyclopentanecarbonitrile

Cyclopentane

cyclopentene

Refernces

• 1、 De Lue,N.R.,Brown,H.C.. "-". . p. 114 - 116. Retrieved 1976.
• 2、 Gore,J. et al.. "-". . p. 821 - 822. Retrieved 1973.
• 3、 Applequist,O'Brien. "". . p. 743,747. Retrieved 1963.
• 4、 Yang, Zhen,Koenigs, Rene M.. "Photoinduced Palladium-Catalyzed Dicarbofunctionalization of Terminal Alkynes". supporting information. p. 3694 - 3699. Retrieved 2021/02/01.
• 5、 Wang, Xiaochen,Zhu, Binbing,Dong, Jianyang,Tian, Hao,Liu, Yuxiu,Song, Hongjian,Wang, Qingmin. "Visible-light-mediated multicomponent reaction for secondary amine synthesis". supporting information. p. 5028 - 5031. Retrieved 2021/05/28.