Hexadecanoic acid, 4-hydroxybutyl ester
TL;DR: Hexadecanoic acid, 4-hydroxybutyl ester (CAS 5384-26-9) is a chemical compound with molecular formula C20H40O3 and molecular weight 328.30 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-hydroxybutyl hexadecanoate
Also Known As: O-Palmitoylbutane-1,4-diol, 1,4-Butanediol monopalmitate, 4-hydroxybutyl hexadecanoate, Palmitic acid, 4-hydroxybutyl ester, Hexadecanoic acid, 4-hydroxybutyl ester
| Molecular Formula | C20H40O3 |
|---|---|
| Molecular Weight | 328.30 g/mol |
| LogP | 7.5 |
| Topological Polar Surface Area | 46.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 19 |
| Exact Mass | 328.29776 |
| Heavy Atoms | 23 |
| Complexity | 241.0 |
Chemical Identifiers
| CAS Number | 5384-26-9 |
|---|---|
| SMILES | CCCCCCCCCCCCCCCC(=O)OCCCCO |
| InChIKey | XWFLUBQOIDFKOM-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 4 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Hexadecanoic acid, 4-hydroxybutyl ester (CAS 5384-26-9), with molecular formula C20H40O3 and molecular weight 328.30 g/mol. IUPAC: 4-hydroxybutyl hexadecanoate.
Chemical Property Profile of Hexadecanoic acid, 4-hydroxybutyl ester
Property Insights of Hexadecanoic acid, 4-hydroxybutyl ester
The XLogP value of 7.5 indicates that Hexadecanoic acid, 4-hydroxybutyl ester is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 46.5 Ų, Hexadecanoic acid, 4-hydroxybutyl ester exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Hexadecanoic acid, 4-hydroxybutyl ester has 1 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Hexadecanoic acid, 4-hydroxybutyl ester?
The CAS number of Hexadecanoic acid, 4-hydroxybutyl ester is 5384-26-9.
What is the molecular formula of Hexadecanoic acid, 4-hydroxybutyl ester?
The molecular formula of Hexadecanoic acid, 4-hydroxybutyl ester is C20H40O3.
What is the molecular weight of Hexadecanoic acid, 4-hydroxybutyl ester?
The molecular weight of Hexadecanoic acid, 4-hydroxybutyl ester is 328.30 g/mol.
Where can I buy Hexadecanoic acid, 4-hydroxybutyl ester?
You can request a quote for Hexadecanoic acid, 4-hydroxybutyl ester directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Hexadecanoic acid, 4-hydroxybutyl ester?
Yes, KEHONG BIO provides custom synthesis services for Hexadecanoic acid, 4-hydroxybutyl ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.