Octadecanoic acid, 9-hydroxy-, methyl ester
TL;DR: Octadecanoic acid, 9-hydroxy-, methyl ester (CAS 2447-53-2) 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 9-hydroxyoctadecanoate
Also Known As: Methyl 9-hydroxystearate, Methyl 9-hydroxyoctadecanoate, 9-Hydroxystearicacidmethylester, Octadecanoic acid, 9-hydroxy-, methyl ester, Methyl 9-hydroxyoctadecanoate #
| Molecular Formula | C19H38O3 |
|---|---|
| Molecular Weight | 314.28 g/mol |
| LogP | 6.6 |
| 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 | 2447-53-2 |
|---|---|
| SMILES | CCCCCCCCCC(CCCCCCCC(=O)OC)O |
| InChIKey | QDFNTRIETZJNIC-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 3 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Octadecanoic acid, 9-hydroxy-, methyl ester (CAS 2447-53-2), with molecular formula C19H38O3 and molecular weight 314.28 g/mol. IUPAC: methyl 9-hydroxyoctadecanoate.
Chemical Property Profile of Octadecanoic acid, 9-hydroxy-, methyl ester
Property Insights of Octadecanoic acid, 9-hydroxy-, methyl ester
The XLogP value of 6.6 indicates that Octadecanoic acid, 9-hydroxy-, methyl 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, Octadecanoic acid, 9-hydroxy-, methyl ester exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Octadecanoic acid, 9-hydroxy-, methyl 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 Octadecanoic acid, 9-hydroxy-, methyl ester?
The CAS number of Octadecanoic acid, 9-hydroxy-, methyl ester is 2447-53-2.
What is the molecular formula of Octadecanoic acid, 9-hydroxy-, methyl ester?
The molecular formula of Octadecanoic acid, 9-hydroxy-, methyl ester is C19H38O3.
What is the molecular weight of Octadecanoic acid, 9-hydroxy-, methyl ester?
The molecular weight of Octadecanoic acid, 9-hydroxy-, methyl ester is 314.28 g/mol.
Where can I buy Octadecanoic acid, 9-hydroxy-, methyl ester?
You can request a quote for Octadecanoic acid, 9-hydroxy-, methyl ester directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Octadecanoic acid, 9-hydroxy-, methyl ester?
Yes, KEHONG BIO provides custom synthesis services for Octadecanoic acid, 9-hydroxy-, methyl ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.