Methyl 18-oxononadecanoate
TL;DR: Methyl 18-oxononadecanoate (CAS 54725-53-0) is a chemical compound with molecular formula C20H38O3 and molecular weight 326.28 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 18-oxononadecanoate
Also Known As: Methyl 18-oxononadecanoate, Methyl 18-oxononadecanoate #, 18-Oxononadecanoic acid methyl ester, Nonadecanoic acid, 18-oxo-, methyl ester
| Molecular Formula | C20H38O3 |
|---|---|
| Molecular Weight | 326.28 g/mol |
| LogP | 6.9 |
| Topological Polar Surface Area | 43.4 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 18 |
| Exact Mass | 326.2821 |
| Heavy Atoms | 23 |
| Complexity | 287.0 |
Chemical Identifiers
| CAS Number | 54725-53-0 |
|---|---|
| SMILES | CC(=O)CCCCCCCCCCCCCCCCC(=O)OC |
| InChIKey | AZZAWRHDAHLPQE-UHFFFAOYSA-N |
Product Overview
Methyl 18-oxononadecanoate (CAS 54725-53-0), with molecular formula C20H38O3 and molecular weight 326.28 g/mol. IUPAC: methyl 18-oxononadecanoate.
Chemical Property Profile of Methyl 18-oxononadecanoate
Property Insights of Methyl 18-oxononadecanoate
The XLogP value of 6.9 indicates that Methyl 18-oxononadecanoate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 43.4 Ų, Methyl 18-oxononadecanoate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Methyl 18-oxononadecanoate 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 Methyl 18-oxononadecanoate?
The CAS number of Methyl 18-oxononadecanoate is 54725-53-0.
What is the molecular formula of Methyl 18-oxononadecanoate?
The molecular formula of Methyl 18-oxononadecanoate is C20H38O3.
What is the molecular weight of Methyl 18-oxononadecanoate?
The molecular weight of Methyl 18-oxononadecanoate is 326.28 g/mol.
Where can I buy Methyl 18-oxononadecanoate?
You can request a quote for Methyl 18-oxononadecanoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Methyl 18-oxononadecanoate?
Yes, KEHONG BIO provides custom synthesis services for Methyl 18-oxononadecanoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.