二十二烷酸9-羟十八烷基酯
TL;DR: 二十二烷酸9-羟十八烷基酯 (CAS 67801-69-8) is a chemical compound with molecular formula C40H80O3 and molecular weight 608.61 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
二十二烷酸9-羟十八烷基酯
9-hydroxyoctadecyl docosanoate
Also Known As: 9-Hydroxyoctadecyl docosanoate, 9-Hydroxystearyl behenate, 9-hydroxyoctadecyldocosanoate, Docosanoic acid, 9-hydroxyoctadecyl ester, Behenic acid, 9-hydroxystearyl ester
| Molecular Formula | C40H80O3 |
|---|---|
| Molecular Weight | 608.61 g/mol |
| LogP | 17.6 |
| Topological Polar Surface Area | 46.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 38 |
| Exact Mass | 608.6107 |
| Heavy Atoms | 43 |
| Complexity | 520.0 |
Chemical Identifiers
| CAS Number | 67801-69-8 |
|---|---|
| SMILES | CCCCCCCCCCCCCCCCCCCCCC(=O)OCCCCCCCCC(CCCCCCCCC)O |
| InChIKey | IGBQVHZKDCXCLW-UHFFFAOYSA-N |
Product Overview
二十二烷酸9-羟十八烷基酯 (CAS 67801-69-8), with molecular formula C40H80O3 and molecular weight 608.61 g/mol. IUPAC: 9-hydroxyoctadecyl docosanoate.
Chemical Property Profile of 二十二烷酸9-羟十八烷基酯
Property Insights of 二十二烷酸9-羟十八烷基酯
The XLogP value of 17.6 indicates that 二十二烷酸9-羟十八烷基酯 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 46.5 Ų, 二十二烷酸9-羟十八烷基酯 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 二十二烷酸9-羟十八烷基酯 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 二十二烷酸9-羟十八烷基酯?
The CAS number of 二十二烷酸9-羟十八烷基酯 is 67801-69-8.
What is the molecular formula of 二十二烷酸9-羟十八烷基酯?
The molecular formula of 二十二烷酸9-羟十八烷基酯 is C40H80O3.
What is the molecular weight of 二十二烷酸9-羟十八烷基酯?
The molecular weight of 二十二烷酸9-羟十八烷基酯 is 608.61 g/mol.
Where can I buy 二十二烷酸9-羟十八烷基酯?
You can request a quote for 二十二烷酸9-羟十八烷基酯 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 二十二烷酸9-羟十八烷基酯?
Yes, KEHONG BIO provides custom synthesis services for 二十二烷酸9-羟十八烷基酯 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.