香叶醇辛酸酯
TL;DR: 香叶醇辛酸酯 (CAS 51532-26-4) is a chemical compound with molecular formula C18H32O2 and molecular weight 280.24 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
香叶醇辛酸酯
3,7-dimethylocta-2,6-dienyl octanoate
Also Known As: Geranyl caprylate, Geranyl octanoate, Geranyl caprylate (natural), Octanoic acid, (2E)-3,7-dimethyl-2,6-octadienyl ester, Octanoic acid, 3,7-dimethyl-2,6-octadienyl ester, (E)-
| Molecular Formula | C18H32O2 |
|---|---|
| Molecular Weight | 280.24 g/mol |
| LogP | 6.5 |
| Topological Polar Surface Area | 26.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 12 |
| Exact Mass | 280.24023 |
| Heavy Atoms | 20 |
| Complexity | 309.0 |
Chemical Identifiers
| CAS Number | 51532-26-4 |
|---|---|
| SMILES | CCCCCCCC(=O)OCC=C(C)CCC=C(C)C |
| InChIKey | YYBMOGCOPQVSLQ-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 7 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
香叶醇辛酸酯 (CAS 51532-26-4), with molecular formula C18H32O2 and molecular weight 280.24 g/mol. IUPAC: 3,7-dimethylocta-2,6-dienyl octanoate.
Chemical Property Profile of 香叶醇辛酸酯
Property Insights of 香叶醇辛酸酯
The XLogP value of 6.5 indicates that 香叶醇辛酸酯 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 26.3 Ų, 香叶醇辛酸酯 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 香叶醇辛酸酯 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 香叶醇辛酸酯?
The CAS number of 香叶醇辛酸酯 is 51532-26-4.
What is the molecular formula of 香叶醇辛酸酯?
The molecular formula of 香叶醇辛酸酯 is C18H32O2.
What is the molecular weight of 香叶醇辛酸酯?
The molecular weight of 香叶醇辛酸酯 is 280.24 g/mol.
Where can I buy 香叶醇辛酸酯?
You can request a quote for 香叶醇辛酸酯 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 香叶醇辛酸酯?
Yes, KEHONG BIO provides custom synthesis services for 香叶醇辛酸酯 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.