广藿香醇
TL;DR: 广藿香醇 (CAS 5986-55-0) 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.
广藿香醇
(6S,8S)-2,2,6,8-tetramethyltricyclo[5.3.1.03,8]undecan-3-ol
Also Known As: Patchouli alcohol, patchouli camphor, (-)-patchoulol, EINECS 227-807-2, I07-0285
| Molecular Formula | C15H26O |
|---|---|
| Molecular Weight | 222.20 g/mol |
| LogP | 4.1 |
| 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 | 321.0 |
Chemical Identifiers
| CAS Number | 5986-55-0 |
|---|---|
| SMILES | C[C@H]1CCC2([C@@]3(C1CC(C2(C)C)CC3)C)O |
| InChIKey | GGHMUJBZYLPWFD-DUNKBJDJSA-N |
Patent-Derived Application Labels
Derived from 6 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
广藿香醇 (CAS 5986-55-0), with molecular formula C15H26O and molecular weight 222.20 g/mol. IUPAC: (6S,8S)-2,2,6,8-tetramethyltricyclo[5.3.1.03,8]undecan-3-ol.
Chemical Property Profile of 广藿香醇
Property Insights of 广藿香醇
The XLogP value of 4.1 indicates that 广藿香醇 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 20.2 Ų, 广藿香醇 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 广藿香醇 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 广藿香醇?
The CAS number of 广藿香醇 is 5986-55-0.
What is the molecular formula of 广藿香醇?
The molecular formula of 广藿香醇 is C15H26O.
What is the molecular weight of 广藿香醇?
The molecular weight of 广藿香醇 is 222.20 g/mol.
Where can I buy 广藿香醇?
You can request a quote for 广藿香醇 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 广藿香醇?
Yes, KEHONG BIO provides custom synthesis services for 广藿香醇 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.