cis-4-Hexen-1-ol

Base Information

• Chemical Name: cis-4-Hexen-1-ol
• CAS No.: 928-91-6
• Molecular Formula: C6H12O
• Molecular Weight: 100.161
• Hs Code.: 2905290000
• European Community (EC) Number: 213-187-0
• NSC Number: 409218
• UNII: 780WMA6J84
• DSSTox Substance ID: DTXSID10883609
• Nikkaji Number: J126.475C
• Wikidata: Q27266624
• Metabolomics Workbench ID: 44911
• Mol file: 928-91-6.mol

Synonyms:(Z)-hex-2-en-1-ol;(Z)-hex-3-en-1-ol;(Z)-hex-4-en-1-ol;hex-4-en-1-ol

Chemical Property of cis-4-Hexen-1-ol

Chemical Property:

• Appearance/Colour: liquid
• Refractive Index: n20/D 1.443
• Boiling Point: 158.5 °C at 760 mmHg
• PKA: 15.13±0.10(Predicted)
• Flash Point: 61.1 °C
• PSA: 20.23000
• Density: 0.843 g/cm³
• LogP: 1.33500
• XLogP3: 1.2
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 3
• Exact Mass: 100.088815002
• Heavy Atom Count: 7
• Complexity: 48.1

Purity/Quality:

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

cis-4-Hexen-1-ol ^*data from reagent suppliers

Safty Information:

• Pictogram(s): R10:
• Hazard Codes: R10:
• Statements: 10
• Safety Statements: 16

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC=CCCCO
• Isomeric SMILES: C/C=C\CCCO
• Uses: cis-4-Hexen-1-ol (cas# 928-91-6) is a compound useful in organic synthesis.

Technology Process of cis-4-Hexen-1-ol

There total 49 articles about cis-4-Hexen-1-ol 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: 92.5%

2,4-hexadiene-1-ol (111-28-4) → (Z)-3-Hexen-1-ol (928-96-1) + (E)-3-hexen-1-ol (928-97-2) + hex-4-en-1-ol (6126-50-7,928-91-6,928-92-7) + hexan-1-ol (111-27-3)

Guidance literature:

With hydrogen; (methyl benzoate)Cr(CO)6; In methanol; at 190 - 200 ℃; for 2h; under 36775.4 Torr;

Reference yield: 46.0%

6,8-dioxa-bicyclo[3.2.1]oct-2-ene (27925-22-0) → 5-Hexen-1-ol (821-41-0) + (E)-hex-2-ene-1,6-diol (63974-05-0) + hex-4-en-1-ol (6126-50-7,928-91-6,928-92-7)

Guidance literature:

With lithium aluminium tetrahydride; In 1,2-dimethoxyethane; for 150h; Heating;

Reference yield: 38.0%

Sorbyl alcohol (17102-64-6) → 2-hexen-1-ol (2305-21-7) + hex-4-en-1-ol (6126-50-7,928-91-6,928-92-7) + hexan-1-ol (111-27-3)

Guidance literature:

With ammonium chloride; In methanol; Electrochemical reaction;

DOI:10.1016/S0040-4039(03)01035-9

upstream raw materials:

oxirane

(Z)-2-Butene

4-hexyn-1-ol

3,4-dihydro-2H-pyran

Downstream raw materials:

cis-1-chlorohex-4-ene

threo-2-[1-(phenylseleno)ethyl]tetrahydrofuran

erythro-2-[1-(phenylseleno)ethyl]tetrahydrofuran

2-(1-Phenylselanyl-ethyl)-tetrahydro-furan

Refernces

• 1、 Liu, Bingxue,Liu, Qiang,Liu, Xufang. "Migratory Hydrogenation of Terminal Alkynes by Base/Cobalt Relay Catalysis". . p. 6750 - 6755. Retrieved 2020/03/13.
• 2、 Wozniak, Bartosz,Li, Yuehui,Tin, Sergey,De Vries, Johannes G.. "Rhenium-catalyzed deoxydehydration of renewable triols derived from sugars". supporting information. p. 4433 - 4437. Retrieved 2018/10/17.