(Z)-3-hexen-1-yl decanoate
TL;DR: (Z)-3-hexen-1-yl decanoate (CAS 85554-69-4) is a chemical compound with molecular formula C16H30O2 and molecular weight 254.22 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
hex-3-enyl decanoate
Also Known As: 3-Hexenyl decanoate, (Z)-3-Hexenyl decanoate, (Z)-3-hexen-1-yl decanoate, EINECS 287-601-3, Decanoic acid, (3Z)-3-hexenyl ester
| Molecular Formula | C16H30O2 |
|---|---|
| Molecular Weight | 254.22 g/mol |
| LogP | 6.0 |
| Topological Polar Surface Area | 26.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 13 |
| Exact Mass | 254.22458 |
| Heavy Atoms | 18 |
| Complexity | 209.0 |
Chemical Identifiers
| CAS Number | 85554-69-4 |
|---|---|
| SMILES | CCCCCCCCCC(=O)OCCC=CCC |
| InChIKey | APSRJAGZYONPLL-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 1 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
(Z)-3-hexen-1-yl decanoate (CAS 85554-69-4), with molecular formula C16H30O2 and molecular weight 254.22 g/mol. IUPAC: hex-3-enyl decanoate.
Chemical Property Profile of (Z)-3-hexen-1-yl decanoate
Property Insights of (Z)-3-hexen-1-yl decanoate
The XLogP value of 6.0 indicates that (Z)-3-hexen-1-yl decanoate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 26.3 Ų, (Z)-3-hexen-1-yl decanoate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (Z)-3-hexen-1-yl decanoate has 0 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of (Z)-3-hexen-1-yl decanoate?
The CAS number of (Z)-3-hexen-1-yl decanoate is 85554-69-4.
What is the molecular formula of (Z)-3-hexen-1-yl decanoate?
The molecular formula of (Z)-3-hexen-1-yl decanoate is C16H30O2.
What is the molecular weight of (Z)-3-hexen-1-yl decanoate?
The molecular weight of (Z)-3-hexen-1-yl decanoate is 254.22 g/mol.
Where can I buy (Z)-3-hexen-1-yl decanoate?
You can request a quote for (Z)-3-hexen-1-yl decanoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (Z)-3-hexen-1-yl decanoate?
Yes, KEHONG BIO provides custom synthesis services for (Z)-3-hexen-1-yl decanoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.