6-Chloro-1-hexene

Base Information

• Chemical Name: 6-Chloro-1-hexene
• CAS No.: 928-89-2
• Molecular Formula: C6H11Cl
• Molecular Weight: 118.606
• Hs Code.: 29032900
• European Community (EC) Number: 213-186-5
• UNII: F54S6C1C6H
• DSSTox Substance ID: DTXSID7061304
• Nikkaji Number: J246.795J
• Wikidata: Q72451681
• Mol file: 928-89-2.mol

Synonyms:6-Chloro-1-hexene;6-Chlorohex-1-ene;928-89-2;1-Hexene, 6-chloro-;5-hexenyl chloride;1-Chlorohex-5-ene;5-Hexen-1-yl chloride;EINECS 213-186-5;F54S6C1C6H;6-chlorohexene;1-chloro-5-hexene;UNII-F54S6C1C6H;6-Chloro-1-hexene, 96%;SCHEMBL116622;3-Bromoindole-4-carboxylicAcid;DTXSID7061304;MFCD00039391;AKOS006340933;FS-3981;FT-0633114;EN300-674196;N11935;A844376

Chemical Property of 6-Chloro-1-hexene

Chemical Property:

• Appearance/Colour: colourless liquid
• Vapor Pressure: 7.64mmHg at 25°C
• Refractive Index: n20/D 1.438(lit.)
• Boiling Point: 140.5 °C at 760 mmHg
• Flash Point: 32.6 °C
• PSA: 0.00000
• Density: 0.884 g/cm³
• LogP: 2.58150
• Storage Temp.: Flammables area
• XLogP3: 2.6
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 0
• Rotatable Bond Count: 4
• Exact Mass: 118.0549280
• Heavy Atom Count: 7
• Complexity: 41.4

Purity/Quality:

99% ^*data from raw suppliers

6-Chloro-1-hexene 96% ^*data from reagent suppliers

Safty Information:

• Hazard Codes: Xi
• Statements: 10-36/37/38
• Safety Statements: 16-26-36-37/39

MSDS Files:

SDS file from LookChem

Total 1 MSDS from other Authors

Useful:

• Canonical SMILES: C=CCCCCCl
• Uses: 6-Chloro-1-hexene is used as pharmaceutical intermediate.

Technology Process of 6-Chloro-1-hexene

There total 29 articles about 6-Chloro-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: 91.0%

1-chloro-5-hexyne (10297-06-0) → 6-chlorohexene (928-89-2)

Guidance literature:

With hydrogen; In ethanol; at 20 ℃; for 1.5h; under 760.051 Torr;

DOI:10.1021/acscatal.5b02518

Reference yield: 82.0%

1.3-chlorobromopropane (109-70-6) + allyl bromide (106-95-6) → 6-chlorohexene (928-89-2)

Guidance literature:

allyl bromide; With magnesium; In diethyl ether; for 9h;

In tetrahydrofuran; at 45 - 65 ℃; for 3.16667h;

1.3-chlorobromopropane; In tetrahydrofuran; at 50 - 60 ℃; for 1.5h;

DOI:10.15227/orgsyn.076.0221

Reference yield: 81.0%

diethyl malonate (105-53-3) → 6-chlorohexene (928-89-2)

Guidance literature:

With sodium; In ethanol;

upstream raw materials:

5-Hexen-1-ol

1-chloro-5-hexyne

1,6-hexanediol

1-bromo-6-chlorohexane

Downstream raw materials:

7-Anilino-7,7-diphenyl-1-hepten

1-hexene

methylenecyclopentane

methyl-cyclopentane

Refernces

• 1、 Fudo, Eri,Imai, Shota,Kojima, Yasumi,Kominami, Hiroshi,Tanaka, Atsuhiro. "Controlling the performance of a silver co-catalyst by a palladium core in TiO2-photocatalyzed alkyne semihydrogenation and H2 production". . . Retrieved 2021/08/24.
• 2、 Imai, Shota,Nakanishi, Kousuke,Tanaka, Atsuhiro,Kominami, Hiroshi. "Accelerated Semihydrogenation of Alkynes over a Copper/Palladium/Titanium (IV) Oxide Photocatalyst Free from Poison and H2 Gas". . p. 1609 - 1616. Retrieved 2020/02/15.