9,10-二羟基十八烷酸辛酯
TL;DR: 9,10-二羟基十八烷酸辛酯 (CAS 289660-66-8) is a chemical compound with molecular formula C26H52O4 and molecular weight 428.39 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
9,10-二羟基十八烷酸辛酯
octyl 9,10-dihydroxyoctadecanoate
Also Known As: octyl 9,10-dihydroxyoctadecanoate, octyl 9,10-dihydroxystearate, Octadecanoic acid, 9,10-dihydroxy-, octyl ester, 9,10-Dihydroxystearic acid octyl ester, J2.940.498D
| Molecular Formula | C26H52O4 |
|---|---|
| Molecular Weight | 428.39 g/mol |
| LogP | 8.9 |
| Topological Polar Surface Area | 66.8 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 24 |
| Exact Mass | 428.38657 |
| Heavy Atoms | 30 |
| Complexity | 359.0 |
Chemical Identifiers
| CAS Number | 289660-66-8 |
|---|---|
| SMILES | CCCCCCCCC(C(CCCCCCCC(=O)OCCCCCCCC)O)O |
| InChIKey | HHJMCYJNPMMIBD-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 1 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
9,10-二羟基十八烷酸辛酯 (CAS 289660-66-8), with molecular formula C26H52O4 and molecular weight 428.39 g/mol. IUPAC: octyl 9,10-dihydroxyoctadecanoate.
Chemical Property Profile of 9,10-二羟基十八烷酸辛酯
Property Insights of 9,10-二羟基十八烷酸辛酯
The XLogP value of 8.9 indicates that 9,10-二羟基十八烷酸辛酯 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 66.8 Ų falls within the moderate polarity range, balancing permeability and solubility for 9,10-二羟基十八烷酸辛酯. Following Lipinski's Rule of Five, 9,10-二羟基十八烷酸辛酯 has 2 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 9,10-二羟基十八烷酸辛酯?
The CAS number of 9,10-二羟基十八烷酸辛酯 is 289660-66-8.
What is the molecular formula of 9,10-二羟基十八烷酸辛酯?
The molecular formula of 9,10-二羟基十八烷酸辛酯 is C26H52O4.
What is the molecular weight of 9,10-二羟基十八烷酸辛酯?
The molecular weight of 9,10-二羟基十八烷酸辛酯 is 428.39 g/mol.
Where can I buy 9,10-二羟基十八烷酸辛酯?
You can request a quote for 9,10-二羟基十八烷酸辛酯 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 9,10-二羟基十八烷酸辛酯?
Yes, KEHONG BIO provides custom synthesis services for 9,10-二羟基十八烷酸辛酯 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.