β-石竹烯醇
TL;DR: β-石竹烯醇 (CAS 472-97-9) is a chemical compound with molecular formula C15H26O and molecular weight 222.20 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
β-石竹烯醇
4,4,8-trimethyltricyclo[6.3.1.02,5]dodecan-1-ol
Also Known As: beta-Caryophyllene alcohol, Caryophyllenol, beta-Caryolanol, Caryolan-1-ol, Caryophyllene alcohol
| Molecular Formula | C15H26O |
|---|---|
| Molecular Weight | 222.20 g/mol |
| LogP | 4.2 |
| Topological Polar Surface Area | 20.2 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 0 |
| Exact Mass | 222.19836 |
| Heavy Atoms | 16 |
| Complexity | 309.0 |
| Melting Point | 94 - 96 °C |
| Density | 0.983-0.989 (20°) |
| Solubility | Practically insoluble or insoluble in water |
| Refractive Index | 1.498-1.503 |
Chemical Identifiers
| CAS Number | 472-97-9 |
|---|---|
| SMILES | CC1(CC2C1CCC3(CCCC2(C3)O)C)C |
| InChIKey | FUQAYSQLAOJBBC-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 1 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
β-石竹烯醇 (CAS 472-97-9), with molecular formula C15H26O and molecular weight 222.20 g/mol. IUPAC: 4,4,8-trimethyltricyclo[6.3.1.02,5]dodecan-1-ol.
Chemical Property Profile of β-石竹烯醇
Property Insights of β-石竹烯醇
The XLogP value of 4.2 indicates that β-石竹烯醇 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 20.2 Ų, β-石竹烯醇 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, β-石竹烯醇 has 1 hydrogen bond donor(s) and 1 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 β-石竹烯醇?
The CAS number of β-石竹烯醇 is 472-97-9.
What is the molecular formula of β-石竹烯醇?
The molecular formula of β-石竹烯醇 is C15H26O.
What is the molecular weight of β-石竹烯醇?
The molecular weight of β-石竹烯醇 is 222.20 g/mol.
Where can I buy β-石竹烯醇?
You can request a quote for β-石竹烯醇 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for β-石竹烯醇?
Yes, KEHONG BIO provides custom synthesis services for β-石竹烯醇 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.