Methyl 5-oxohexadecanoate
TL;DR: Methyl 5-oxohexadecanoate (CAS 54527-00-3) is a chemical compound with molecular formula C17H32O3 and molecular weight 284.24 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 5-oxohexadecanoate
Also Known As: Methyl 5-oxohexadecanoate, methyl 5-oxo-hexadecanoate, 5-Ketopalmitic acid methyl ester, 5-Oxohexadecanoic acid methyl ester
| Molecular Formula | C17H32O3 |
|---|---|
| Molecular Weight | 284.24 g/mol |
| LogP | 4.8197 |
| Topological Polar Surface Area | 43.37 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 14 |
| Exact Mass | 284.23514 |
| Heavy Atoms | 20 |
| Complexity | 248.61967 |
Chemical Identifiers
| CAS Number | 54527-00-3 |
|---|---|
| SMILES | CCCCCCCCCCCC(=O)CCCC(=O)OC |
Product Overview
Methyl 5-oxohexadecanoate (CAS 54527-00-3), with molecular formula C17H32O3 and molecular weight 284.24 g/mol. IUPAC: methyl 5-oxohexadecanoate.
Chemical Property Profile of Methyl 5-oxohexadecanoate
Property Insights of Methyl 5-oxohexadecanoate
The XLogP value of 4.8197 indicates that Methyl 5-oxohexadecanoate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 43.37 Ų, Methyl 5-oxohexadecanoate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Methyl 5-oxohexadecanoate has 0 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Methyl 5-oxohexadecanoate?
The CAS number of Methyl 5-oxohexadecanoate is 54527-00-3.
What is the molecular formula of Methyl 5-oxohexadecanoate?
The molecular formula of Methyl 5-oxohexadecanoate is C17H32O3.
What is the molecular weight of Methyl 5-oxohexadecanoate?
The molecular weight of Methyl 5-oxohexadecanoate is 284.24 g/mol.
Where can I buy Methyl 5-oxohexadecanoate?
You can request a quote for Methyl 5-oxohexadecanoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Methyl 5-oxohexadecanoate?
Yes, KEHONG BIO provides custom synthesis services for Methyl 5-oxohexadecanoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.