Methyl 8-hydroxy-9,11-octadecadiynoate
TL;DR: Methyl 8-hydroxy-9,11-octadecadiynoate (CAS 6084-80-6) is a chemical compound with molecular formula C19H30O3 and molecular weight 306.22 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 8-hydroxyoctadeca-9,11-diynoate
Also Known As: Methyl 8-hydroxy-9,11-octadecadiynoate, methyl 8-hydroxyoctadeca-9,11-diynoate, Methyl 8-hydroxy-9,11-octadecadiynoate #, 8-Hydroxy-9,11-octadecadiynoicacidmethylester, 9,11-Octadecadiynoic acid, 8-hydroxy-, methyl ester
| Molecular Formula | C19H30O3 |
|---|---|
| Molecular Weight | 306.22 g/mol |
| LogP | 5.2 |
| Topological Polar Surface Area | 46.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 13 |
| Exact Mass | 306.21948 |
| Heavy Atoms | 22 |
| Complexity | 413.0 |
Chemical Identifiers
| CAS Number | 6084-80-6 |
|---|---|
| SMILES | CCCCCCC#CC#CC(CCCCCCC(=O)OC)O |
| InChIKey | SGRKZXIXJLBTED-UHFFFAOYSA-N |
Product Overview
Methyl 8-hydroxy-9,11-octadecadiynoate (CAS 6084-80-6), with molecular formula C19H30O3 and molecular weight 306.22 g/mol. IUPAC: methyl 8-hydroxyoctadeca-9,11-diynoate.
Chemical Property Profile of Methyl 8-hydroxy-9,11-octadecadiynoate
Property Insights of Methyl 8-hydroxy-9,11-octadecadiynoate
The XLogP value of 5.2 indicates that Methyl 8-hydroxy-9,11-octadecadiynoate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 46.5 Ų, Methyl 8-hydroxy-9,11-octadecadiynoate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Methyl 8-hydroxy-9,11-octadecadiynoate has 1 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 8-hydroxy-9,11-octadecadiynoate?
The CAS number of Methyl 8-hydroxy-9,11-octadecadiynoate is 6084-80-6.
What is the molecular formula of Methyl 8-hydroxy-9,11-octadecadiynoate?
The molecular formula of Methyl 8-hydroxy-9,11-octadecadiynoate is C19H30O3.
What is the molecular weight of Methyl 8-hydroxy-9,11-octadecadiynoate?
The molecular weight of Methyl 8-hydroxy-9,11-octadecadiynoate is 306.22 g/mol.
Where can I buy Methyl 8-hydroxy-9,11-octadecadiynoate?
You can request a quote for Methyl 8-hydroxy-9,11-octadecadiynoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Methyl 8-hydroxy-9,11-octadecadiynoate?
Yes, KEHONG BIO provides custom synthesis services for Methyl 8-hydroxy-9,11-octadecadiynoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.