Octadecanoic acid, 4-oxo-, methyl ester
TL;DR: Octadecanoic acid, 4-oxo-, methyl ester (CAS 2380-19-0) is a chemical compound with molecular formula C19H36O3 and molecular weight 312.27 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 4-oxooctadecanoate
Also Known As: Methyl 4-oxooctadecanoate, methyl 4-ketostearate, 4-Ketostearicacidmethylester, Methyl 4-oxooctadecanoate #, 4-Ketostearic acid methyl ester
| Molecular Formula | C19H36O3 |
|---|---|
| Molecular Weight | 312.27 g/mol |
| LogP | 6.5 |
| Topological Polar Surface Area | 43.4 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 17 |
| Exact Mass | 312.26645 |
| Heavy Atoms | 22 |
| Complexity | 274.0 |
Chemical Identifiers
| CAS Number | 2380-19-0 |
|---|---|
| SMILES | CCCCCCCCCCCCCCC(=O)CCC(=O)OC |
| InChIKey | UIUPUTHABPRTHT-UHFFFAOYSA-N |
Product Overview
Octadecanoic acid, 4-oxo-, methyl ester (CAS 2380-19-0), with molecular formula C19H36O3 and molecular weight 312.27 g/mol. IUPAC: methyl 4-oxooctadecanoate.
Chemical Property Profile of Octadecanoic acid, 4-oxo-, methyl ester
Property Insights of Octadecanoic acid, 4-oxo-, methyl ester
The XLogP value of 6.5 indicates that Octadecanoic acid, 4-oxo-, methyl ester is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 43.4 Ų, Octadecanoic acid, 4-oxo-, methyl ester exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Octadecanoic acid, 4-oxo-, methyl ester has 0 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, 4-oxo-, methyl ester?
The CAS number of Octadecanoic acid, 4-oxo-, methyl ester is 2380-19-0.
What is the molecular formula of Octadecanoic acid, 4-oxo-, methyl ester?
The molecular formula of Octadecanoic acid, 4-oxo-, methyl ester is C19H36O3.
What is the molecular weight of Octadecanoic acid, 4-oxo-, methyl ester?
The molecular weight of Octadecanoic acid, 4-oxo-, methyl ester is 312.27 g/mol.
Where can I buy Octadecanoic acid, 4-oxo-, methyl ester?
You can request a quote for Octadecanoic acid, 4-oxo-, 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, 4-oxo-, methyl ester?
Yes, KEHONG BIO provides custom synthesis services for Octadecanoic acid, 4-oxo-, methyl ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.