Octadecanoic acid, 3-hydroxy-2-(1-oxotetradecyl)-, methyl ester
TL;DR: Octadecanoic acid, 3-hydroxy-2-(1-oxotetradecyl)-, methyl ester (CAS 56554-23-5) is a chemical compound with molecular formula C33H64O4 and molecular weight 524.48 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 3-hydroxy-2-tetradecanoyloctadecanoate
Also Known As: Methyl 3-hydroxy-2-tetradecanoyloctadecanoate, 2-Tetradecanoyl-3-hydroxyoctadecanoicacidmethylester, Methyl 3-hydroxy-2-tetradecanoyloctadecanoate #, 2-Tetradecanoyl-3-hydroxyoctadecanoic acid methyl ester, Octadecanoic acid, 3-hydroxy-2-(1-oxotetradecyl)-, methyl ester
| Molecular Formula | C33H64O4 |
|---|---|
| Molecular Weight | 524.48 g/mol |
| LogP | 13.4 |
| Topological Polar Surface Area | 63.6 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 30 |
| Exact Mass | 524.48047 |
| Heavy Atoms | 37 |
| Complexity | 505.0 |
Chemical Identifiers
| CAS Number | 56554-23-5 |
|---|---|
| SMILES | CCCCCCCCCCCCCCCC(C(C(=O)CCCCCCCCCCCCC)C(=O)OC)O |
| InChIKey | NRXOQRQOKHDQQJ-UHFFFAOYSA-N |
Product Overview
Octadecanoic acid, 3-hydroxy-2-(1-oxotetradecyl)-, methyl ester (CAS 56554-23-5), with molecular formula C33H64O4 and molecular weight 524.48 g/mol. IUPAC: methyl 3-hydroxy-2-tetradecanoyloctadecanoate.
Chemical Property Profile of Octadecanoic acid, 3-hydroxy-2-(1-oxotetradecyl)-, methyl ester
Property Insights of Octadecanoic acid, 3-hydroxy-2-(1-oxotetradecyl)-, methyl ester
The XLogP value of 13.4 indicates that Octadecanoic acid, 3-hydroxy-2-(1-oxotetradecyl)-, methyl ester is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 63.6 Ų falls within the moderate polarity range, balancing permeability and solubility for Octadecanoic acid, 3-hydroxy-2-(1-oxotetradecyl)-, methyl ester. Following Lipinski's Rule of Five, Octadecanoic acid, 3-hydroxy-2-(1-oxotetradecyl)-, methyl ester has 1 hydrogen bond donor(s) and 4 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, 3-hydroxy-2-(1-oxotetradecyl)-, methyl ester?
The CAS number of Octadecanoic acid, 3-hydroxy-2-(1-oxotetradecyl)-, methyl ester is 56554-23-5.
What is the molecular formula of Octadecanoic acid, 3-hydroxy-2-(1-oxotetradecyl)-, methyl ester?
The molecular formula of Octadecanoic acid, 3-hydroxy-2-(1-oxotetradecyl)-, methyl ester is C33H64O4.
What is the molecular weight of Octadecanoic acid, 3-hydroxy-2-(1-oxotetradecyl)-, methyl ester?
The molecular weight of Octadecanoic acid, 3-hydroxy-2-(1-oxotetradecyl)-, methyl ester is 524.48 g/mol.
Where can I buy Octadecanoic acid, 3-hydroxy-2-(1-oxotetradecyl)-, methyl ester?
You can request a quote for Octadecanoic acid, 3-hydroxy-2-(1-oxotetradecyl)-, 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, 3-hydroxy-2-(1-oxotetradecyl)-, methyl ester?
Yes, KEHONG BIO provides custom synthesis services for Octadecanoic acid, 3-hydroxy-2-(1-oxotetradecyl)-, methyl ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.