Methyl 3-hydroxyoctadecanoate
TL;DR: Methyl 3-hydroxyoctadecanoate (CAS 14531-40-9) is a chemical compound with molecular formula C19H38O3 and molecular weight 314.28 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 3-hydroxyoctadecanoate
Also Known As: Methyl 3-hydroxyoctadecanoate, 3-Hydroxyoctadecanoic acid methyl ester, 3-hydroxy Stearic Acid methyl ester, Octadecanoic acid, 3-hydroxy-, methyl ester, Methyl 3-Hydroxyoctadecanoate, (C18)
| Molecular Formula | C19H38O3 |
|---|---|
| Molecular Weight | 314.28 g/mol |
| LogP | 7.2 |
| Topological Polar Surface Area | 46.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 17 |
| Exact Mass | 314.2821 |
| Heavy Atoms | 22 |
| Complexity | 241.0 |
Chemical Identifiers
| CAS Number | 14531-40-9 |
|---|---|
| SMILES | CCCCCCCCCCCCCCCC(CC(=O)OC)O |
| InChIKey | XIGHAQIRKIFLFB-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 1 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Methyl 3-hydroxyoctadecanoate (CAS 14531-40-9), with molecular formula C19H38O3 and molecular weight 314.28 g/mol. IUPAC: methyl 3-hydroxyoctadecanoate.
Chemical Property Profile of Methyl 3-hydroxyoctadecanoate
Property Insights of Methyl 3-hydroxyoctadecanoate
The XLogP value of 7.2 indicates that Methyl 3-hydroxyoctadecanoate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 46.5 Ų, Methyl 3-hydroxyoctadecanoate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Methyl 3-hydroxyoctadecanoate 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 Methyl 3-hydroxyoctadecanoate?
The CAS number of Methyl 3-hydroxyoctadecanoate is 14531-40-9.
What is the molecular formula of Methyl 3-hydroxyoctadecanoate?
The molecular formula of Methyl 3-hydroxyoctadecanoate is C19H38O3.
What is the molecular weight of Methyl 3-hydroxyoctadecanoate?
The molecular weight of Methyl 3-hydroxyoctadecanoate is 314.28 g/mol.
Where can I buy Methyl 3-hydroxyoctadecanoate?
You can request a quote for Methyl 3-hydroxyoctadecanoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Methyl 3-hydroxyoctadecanoate?
Yes, KEHONG BIO provides custom synthesis services for Methyl 3-hydroxyoctadecanoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.