trans-1-Iodo-1-Hexene

Base Information

• Chemical Name: trans-1-Iodo-1-Hexene
• CAS No.: 16644-98-7
• Molecular Formula: C6H11I
• Molecular Weight: 210.058
• Hs Code.: 2903399090
• European Community (EC) Number: 624-807-8
• Nikkaji Number: J337.510B,J113.191E
• Mol file: 16644-98-7.mol

Synonyms:trans-1-Iodo-1-Hexene;16644-98-7;(E)-1-iodohex-1-ene;1(E)-Iodo-hex-1-ene;1-Hexene, 1-iodo-, (E)-;hexenyl iodide;1-iodo-1-hexene;trans-1-Iodohexene;starbld0038468;trans-1-Hexenyl Iodide;(E)-1-Iodo-1-hexene;(E)-1-iodo-hex-1-ene;(1E)-1-Iodo-1-hexene;SCHEMBL537405;(1E)-1-Iodo-1-hexene #;(1E)-1-IODOHEX-1-ENE;MFCD00798209;AT25371;J-010286;trans-1-Iodo-1-hexene, technical grade, >=90% (GC)

Chemical Property of trans-1-Iodo-1-Hexene

Chemical Property:

• Refractive Index: n20/D 1.509
• Boiling Point: 151.64°C (estimate)
• PSA: 0.00000
• Density: 1.4517 (rough estimate)
• LogP: 3.12530
• XLogP3: 3.5
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 0
• Rotatable Bond Count: 3
• Exact Mass: 209.99055
• Heavy Atom Count: 7
• Complexity: 48.1

Purity/Quality:

98%Min ^*data from raw suppliers

TRANS-1-IODO-1-HEXENE 95.00% ^*data from reagent suppliers

Safty Information:

• Pictogram(s): 1840329
• Hazard Codes: Xn,N
• Statements: 22-51/53
• Safety Statements: 61

MSDS Files:

SDS file from LookChem

Total 1 MSDS from other Authors

Useful:

• Canonical SMILES: CCCCC=CI
• Isomeric SMILES: CCCC/C=C/I

Technology Process of trans-1-Iodo-1-Hexene

There total 27 articles about trans-1-Iodo-1-Hexene 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: 95.0%

(E)-(tert-butyl)(hex-1-enyl)(dimethyl)silane → (E)-1-iodohexene (16644-98-7)

Guidance literature:

With 1,3-Diiodo-5,5-dimethyl-2,4-imidazolidinedione; In 1,1,1,3',3',3'-hexafluoro-propanol; at 0 ℃; Inert atmosphere; Darkness;

DOI:10.1021/ol2020187

Reference yield: 83.0%

(E)-1-hexenyldihydroxyborane (42599-18-8) → (E)-1-iodohexene (16644-98-7)

Guidance literature:

With chloroamine-T; sodium iodide; In tetrahydrofuran; for 0.25h;

Reference yield: 78.0%

diisopropylcarbamic acid (E)-hex-1-enyl ester (648927-67-7) → (E)-1-iodohexene (16644-98-7)

Guidance literature:

diisopropylcarbamic acid (E)-hex-1-enyl ester; With n-butyllithium; zirconocene dichloride; In diethyl ether; hexane; at 20 ℃; for 1.5h;

With iodine; In diethyl ether; hexane; at 20 ℃; for 1h;

DOI:10.1055/s-2005-918436

upstream raw materials:

(Z)-hex-1-enyl(trimethyl)silane

(E)-1-bromohex-1-ene

(E)-1-hexenyldihydroxyborane

2-Iodothiophene

Downstream raw materials:

(E)-5-dodecen-7-yne

(E,E)-2,4-nonadienal

1-butyldecene

(E,E)-1-((1R,2S,5R)-8-phenylmenthyloxy)-1,3-octadiene

Refernces

• 1、 Svatos, Ales,Kalinova, Blanka,Kindl, Jiri,Kuldova, Jelena,Hovorka, Oldrich,Do Nascimento, Ruth Rufino,Oldham, Neil J.. "Chemical characterization and synthesis of the major component of the sex pheromone of the sugarcane borer Diatraea saccharalis". . p. 1682 - 1690. Retrieved 2001.
• 2、 Brown,H.C. et al.. "-". . p. 5786 - 5788. Retrieved 1973.
• 3、 Brown, Herbert C.,Campbell, James B.. "Hydroboration. 55. Hydroboration of Alkynes with Dibromoborane-Dimethyl Sulfide. Convenient Preparation of Alkenyldibromoboranes". . p. 389 - 395. Retrieved 1980.
• 4、 Bower, John F.,Cadge, Jamie A.,Russell, Christopher A.,Sparkes, Hazel A.. "Oxidative Addition of Alkenyl and Alkynyl Iodides to a AuI Complex". supporting information. p. 6617 - 6621. Retrieved 2020/03/13.
• 5、 Saikia, Bishwajit,Joymati Devi, Thongam,Barua, Nabin C.. "First total synthesis of Debilisone C". . p. 905 - 913. Retrieved 2013/03/14.