(Z)-3-Hexenyl octanoate

Base Information

• Chemical Name: (Z)-3-Hexenyl octanoate
• CAS No.: 61444-41-5
• Molecular Formula: C14H26 O2
• Molecular Weight: 226.359
• European Community (EC) Number: 262-799-4
• DSSTox Substance ID: DTXSID101020052
• Nikkaji Number: J279.641D
• Wikidata: Q67866068
• Mol file: 61444-41-5.mol

Synonyms:cis-3-Hexenyl caprylate;(Z)-3-Hexenyl octanoate;61444-41-5;3-Hexenyl octanoate;Octanoic acid, 3-hexenyl ester, (Z)-;cis-3-Hexanyl n-octanoate;EINECS 262-799-4;[(Z)-hex-3-enyl] octanoate;Octanoic acid, (3Z)-3-hexenyl ester;cis-3-hexenyl octanoate;(3Z)-3-Hexenyl octanoate;SCHEMBL3508497;DYIDDAHHUMHEEQ-VURMDHGXSA-N;DTXSID101020052;Octanoic acid (Z)-3-hexenyl ester;(3Z)-HEX-3-EN-1-YL OCTANOATE;Octanoic acid, (3Z)-3-hexen-1-yl ester;Q67866068

Chemical Property of (Z)-3-Hexenyl octanoate

Chemical Property:

• Vapor Pressure: 0.00183mmHg at 25°C
• Boiling Point: 292.5°C at 760 mmHg
• Flash Point: 91.4°C
• PSA: 26.30000
• Density: 0.881g/cm³
• LogP: 4.24640
• XLogP3: 4.9
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 11
• Exact Mass: 226.193280068
• Heavy Atom Count: 16
• Complexity: 185

Purity/Quality:

98.5% ^*data from raw suppliers

CIS-3-HEXENYL CAPRYLATE 95.00% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCCCCCCC(=O)OCCC=CCC
• Isomeric SMILES: CCCCCCCC(=O)OCC/C=C\CC

Technology Process of (Z)-3-Hexenyl octanoate

There total 1 articles about (Z)-3-Hexenyl octanoate 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:

→ (Z)-3-hexenyl octanoate (61444-41-5,87619-90-7)

Guidance literature:

entspr. Hexenol, Caprylsaeure;