Methyl margarate
TL;DR: Methyl margarate (CAS 1731-92-6) is a chemical compound with molecular formula C18H36O2 and molecular weight 284.27 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl heptadecanoate
Also Known As: METHYL HEPTADECANOATE, Methyl margarate, Heptadecanoic acid, methyl ester, Margaric acid methyl ester, methylheptadecanoate
| Molecular Formula | C18H36O2 |
|---|---|
| Molecular Weight | 284.27 g/mol |
| LogP | 8.5 |
| Topological Polar Surface Area | 26.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 16 |
| Exact Mass | 284.27155 |
| Heavy Atoms | 20 |
| Complexity | 202.0 |
Chemical Identifiers
| CAS Number | 1731-92-6 |
|---|---|
| SMILES | CCCCCCCCCCCCCCCCC(=O)OC |
| InChIKey | HUEBIMLTDXKIPR-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 12 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Methyl margarate (CAS 1731-92-6), with molecular formula C18H36O2 and molecular weight 284.27 g/mol. IUPAC: methyl heptadecanoate.
Chemical Property Profile of Methyl margarate
Property Insights of Methyl margarate
The XLogP value of 8.5 indicates that Methyl margarate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 26.3 Ų, Methyl margarate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Methyl margarate has 0 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Methyl margarate?
The CAS number of Methyl margarate is 1731-92-6.
What is the molecular formula of Methyl margarate?
The molecular formula of Methyl margarate is C18H36O2.
What is the molecular weight of Methyl margarate?
The molecular weight of Methyl margarate is 284.27 g/mol.
Where can I buy Methyl margarate?
You can request a quote for Methyl margarate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Methyl margarate?
Yes, KEHONG BIO provides custom synthesis services for Methyl margarate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.