Methyl 8-oxo-17-octadecene-9,11-diynoate
TL;DR: Methyl 8-oxo-17-octadecene-9,11-diynoate (CAS 75112-83-3) is a chemical compound with molecular formula C19H26O3 and molecular weight 302.19 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 8-oxooctadec-17-en-9,11-diynoate
Also Known As: Methyl 8-oxo-17-octadecene-9,11-diynoate, methyl 8-oxooctadec-17-en-9,11-diynoate, Methyl 8-oxooctadec-17-ene-9,11-diynoate, Methyl 8-oxo-17-octadecene-9,11-diynoate #, 17-Octadecene-9,11-diynoic acid, 8-oxo-, methyl ester
| Molecular Formula | C19H26O3 |
|---|---|
| Molecular Weight | 302.19 g/mol |
| LogP | 5.0 |
| Topological Polar Surface Area | 43.4 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 13 |
| Exact Mass | 302.1882 |
| Heavy Atoms | 22 |
| Complexity | 476.0 |
Chemical Identifiers
| CAS Number | 75112-83-3 |
|---|---|
| SMILES | COC(=O)CCCCCCC(=O)C#CC#CCCCCC=C |
| InChIKey | XXDZFPWYPIWNOF-UHFFFAOYSA-N |
Product Overview
Methyl 8-oxo-17-octadecene-9,11-diynoate (CAS 75112-83-3), with molecular formula C19H26O3 and molecular weight 302.19 g/mol. IUPAC: methyl 8-oxooctadec-17-en-9,11-diynoate.
Chemical Property Profile of Methyl 8-oxo-17-octadecene-9,11-diynoate
Property Insights of Methyl 8-oxo-17-octadecene-9,11-diynoate
The XLogP value of 5.0 indicates that Methyl 8-oxo-17-octadecene-9,11-diynoate 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 8-oxo-17-octadecene-9,11-diynoate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Methyl 8-oxo-17-octadecene-9,11-diynoate 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 8-oxo-17-octadecene-9,11-diynoate?
The CAS number of Methyl 8-oxo-17-octadecene-9,11-diynoate is 75112-83-3.
What is the molecular formula of Methyl 8-oxo-17-octadecene-9,11-diynoate?
The molecular formula of Methyl 8-oxo-17-octadecene-9,11-diynoate is C19H26O3.
What is the molecular weight of Methyl 8-oxo-17-octadecene-9,11-diynoate?
The molecular weight of Methyl 8-oxo-17-octadecene-9,11-diynoate is 302.19 g/mol.
Where can I buy Methyl 8-oxo-17-octadecene-9,11-diynoate?
You can request a quote for Methyl 8-oxo-17-octadecene-9,11-diynoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Methyl 8-oxo-17-octadecene-9,11-diynoate?
Yes, KEHONG BIO provides custom synthesis services for Methyl 8-oxo-17-octadecene-9,11-diynoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.