Methyl sterculate
TL;DR: Methyl sterculate (CAS 3220-60-8) is a chemical compound with molecular formula C20H36O2 and molecular weight 308.27 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 8-(2-octylcyclopropen-1-yl)octanoate
Also Known As: Methyl sterculate, methylsterculate, Sterculic acid methyl ester, Methyl 8-(2-octylcycloprop-1-en-1-yl)octanoate, Methyl 2-octylcyclopropene-1-octanoate
| Molecular Formula | C20H36O2 |
|---|---|
| Molecular Weight | 308.27 g/mol |
| LogP | 6.8 |
| Topological Polar Surface Area | 26.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 16 |
| Exact Mass | 308.27155 |
| Heavy Atoms | 22 |
| Complexity | 331.0 |
Chemical Identifiers
| CAS Number | 3220-60-8 |
|---|---|
| SMILES | CCCCCCCCC1=C(C1)CCCCCCCC(=O)OC |
| InChIKey | CMRNMZJAUFXOQF-UHFFFAOYSA-N |
Product Overview
Methyl sterculate (CAS 3220-60-8), with molecular formula C20H36O2 and molecular weight 308.27 g/mol. IUPAC: methyl 8-(2-octylcyclopropen-1-yl)octanoate.
Chemical Property Profile of Methyl sterculate
Property Insights of Methyl sterculate
The XLogP value of 6.8 indicates that Methyl sterculate 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 sterculate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Methyl sterculate 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 sterculate?
The CAS number of Methyl sterculate is 3220-60-8.
What is the molecular formula of Methyl sterculate?
The molecular formula of Methyl sterculate is C20H36O2.
What is the molecular weight of Methyl sterculate?
The molecular weight of Methyl sterculate is 308.27 g/mol.
Where can I buy Methyl sterculate?
You can request a quote for Methyl sterculate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Methyl sterculate?
Yes, KEHONG BIO provides custom synthesis services for Methyl sterculate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.