Methyl 3-oxohexadecanoate
TL;DR: Methyl 3-oxohexadecanoate (CAS 14427-53-3) 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 3-oxohexadecanoate
Also Known As: Methyl 3-oxohexadecanoate, methyl-3-oxohexadecanoate, Hexadecanoic acid,3-oxo-, methyl ester, Hexadecanoic acid, 3-oxo-, methyl ester, 3-Ketopalmitic acid methyl ester
| Molecular Formula | C17H32O3 |
|---|---|
| Molecular Weight | 284.24 g/mol |
| LogP | 6.2 |
| Topological Polar Surface Area | 43.4 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 15 |
| Exact Mass | 284.23514 |
| Heavy Atoms | 20 |
| Complexity | 249.0 |
Chemical Identifiers
| CAS Number | 14427-53-3 |
|---|---|
| SMILES | CCCCCCCCCCCCCC(=O)CC(=O)OC |
| InChIKey | OEEDRMFBAHHVQI-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Methyl 3-oxohexadecanoate (CAS 14427-53-3), with molecular formula C17H32O3 and molecular weight 284.24 g/mol. IUPAC: methyl 3-oxohexadecanoate.
Chemical Property Profile of Methyl 3-oxohexadecanoate
Property Insights of Methyl 3-oxohexadecanoate
The XLogP value of 6.2 indicates that Methyl 3-oxohexadecanoate 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 3-oxohexadecanoate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Methyl 3-oxohexadecanoate 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 3-oxohexadecanoate?
The CAS number of Methyl 3-oxohexadecanoate is 14427-53-3.
What is the molecular formula of Methyl 3-oxohexadecanoate?
The molecular formula of Methyl 3-oxohexadecanoate is C17H32O3.
What is the molecular weight of Methyl 3-oxohexadecanoate?
The molecular weight of Methyl 3-oxohexadecanoate is 284.24 g/mol.
Where can I buy Methyl 3-oxohexadecanoate?
You can request a quote for Methyl 3-oxohexadecanoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Methyl 3-oxohexadecanoate?
Yes, KEHONG BIO provides custom synthesis services for Methyl 3-oxohexadecanoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.