Pentyl octadec-9-enoate
TL;DR: Pentyl octadec-9-enoate (CAS 142-57-4) is a chemical compound with molecular formula C23H44O2 and molecular weight 352.33 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
pentyl octadec-9-enoate
Also Known As: pentyl octadec-9-enoate, 9-Octadecenoic acid, pentyl ester, 9-Octadecenoic acid(9Z)-, pentyl ester
| Molecular Formula | C23H44O2 |
|---|---|
| Molecular Weight | 352.33 g/mol |
| LogP | 9.4 |
| Topological Polar Surface Area | 26.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 20 |
| Exact Mass | 352.33414 |
| Heavy Atoms | 25 |
| Complexity | 296.0 |
Chemical Identifiers
| CAS Number | 142-57-4 |
|---|---|
| SMILES | CCCCCCCCC=CCCCCCCCC(=O)OCCCCC |
| InChIKey | YEUKJHYLBPPSQJ-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 10 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Pentyl octadec-9-enoate (CAS 142-57-4), with molecular formula C23H44O2 and molecular weight 352.33 g/mol. IUPAC: pentyl octadec-9-enoate.
Chemical Property Profile of Pentyl octadec-9-enoate
Property Insights of Pentyl octadec-9-enoate
The XLogP value of 9.4 indicates that Pentyl octadec-9-enoate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 26.3 Ų, Pentyl octadec-9-enoate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Pentyl octadec-9-enoate 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 Pentyl octadec-9-enoate?
The CAS number of Pentyl octadec-9-enoate is 142-57-4.
What is the molecular formula of Pentyl octadec-9-enoate?
The molecular formula of Pentyl octadec-9-enoate is C23H44O2.
What is the molecular weight of Pentyl octadec-9-enoate?
The molecular weight of Pentyl octadec-9-enoate is 352.33 g/mol.
Where can I buy Pentyl octadec-9-enoate?
You can request a quote for Pentyl octadec-9-enoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Pentyl octadec-9-enoate?
Yes, KEHONG BIO provides custom synthesis services for Pentyl octadec-9-enoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.