Xibornolum
TL;DR: Xibornolum (CAS 13741-18-9) is a chemical compound with molecular formula C18H26O and molecular weight 258.20 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4,5-dimethyl-2-[(1S,2R,4R)-1,7,7-trimethyl-2-bicyclo[2.2.1]heptanyl]phenol
Also Known As: Xibornol, Bactacine, Nanbacine, Xibornolum, Bracen
| Molecular Formula | C18H26O |
|---|---|
| Molecular Weight | 258.20 g/mol |
| LogP | 5.6 |
| Topological Polar Surface Area | 20.2 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 1 |
| Exact Mass | 258.19836 |
| Heavy Atoms | 19 |
| Complexity | 361.0 |
Chemical Identifiers
| CAS Number | 13741-18-9 |
|---|---|
| SMILES | CC1=CC(=C(C=C1C)O)[C@@H]2C[C@H]3CC[C@@]2(C3(C)C)C |
| InChIKey | RNRHMQWZFJXKLZ-XUWXXGDYSA-N |
Patent-Derived Application Labels
Derived from 1 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Xibornolum (CAS 13741-18-9), with molecular formula C18H26O and molecular weight 258.20 g/mol. IUPAC: 4,5-dimethyl-2-[(1S,2R,4R)-1,7,7-trimethyl-2-bicyclo[2.2.1]heptanyl]phenol.
Chemical Property Profile of Xibornolum
Property Insights of Xibornolum
The XLogP value of 5.6 indicates that Xibornolum is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 20.2 Ų, Xibornolum exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Xibornolum has 1 hydrogen bond donor(s) and 1 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Xibornolum?
The CAS number of Xibornolum is 13741-18-9.
What is the molecular formula of Xibornolum?
The molecular formula of Xibornolum is C18H26O.
What is the molecular weight of Xibornolum?
The molecular weight of Xibornolum is 258.20 g/mol.
Where can I buy Xibornolum?
You can request a quote for Xibornolum directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Xibornolum?
Yes, KEHONG BIO provides custom synthesis services for Xibornolum and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.