beta-Patchoulene
TL;DR: beta-Patchoulene (CAS 514-51-2) is a chemical compound with molecular formula C15H24 and molecular weight 204.19 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1,5,11,11-tetramethyltricyclo[6.2.1.02,6]undec-2(6)-ene
Also Known As: beta-Patchoulene, Patchoulene, b-Patchoulene, beta-Patchouline, .beta.-Patchoulene
| Molecular Formula | C15H24 |
|---|---|
| Molecular Weight | 204.19 g/mol |
| LogP | 4.3 |
| Topological Polar Surface Area | 0.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 0 |
| Rotatable Bonds | 0 |
| Exact Mass | 204.1878 |
| Heavy Atoms | 15 |
| Complexity | 334.0 |
Chemical Identifiers
| CAS Number | 514-51-2 |
|---|---|
| SMILES | CC1CCC2=C1CC3CCC2(C3(C)C)C |
| InChIKey | CSKINCSXMLCMAR-UHFFFAOYSA-N |
Product Overview
beta-Patchoulene (CAS 514-51-2), with molecular formula C15H24 and molecular weight 204.19 g/mol. IUPAC: 1,5,11,11-tetramethyltricyclo[6.2.1.02,6]undec-2(6)-ene.
Chemical Property Profile of beta-Patchoulene
Property Insights of beta-Patchoulene
The XLogP value of 4.3 indicates that beta-Patchoulene is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 0.0 Ų, beta-Patchoulene exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, beta-Patchoulene has 0 hydrogen bond donor(s) and 0 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 beta-Patchoulene?
The CAS number of beta-Patchoulene is 514-51-2.
What is the molecular formula of beta-Patchoulene?
The molecular formula of beta-Patchoulene is C15H24.
What is the molecular weight of beta-Patchoulene?
The molecular weight of beta-Patchoulene is 204.19 g/mol.
Where can I buy beta-Patchoulene?
You can request a quote for beta-Patchoulene directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for beta-Patchoulene?
Yes, KEHONG BIO provides custom synthesis services for beta-Patchoulene and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.