alpha-Cubebene
TL;DR: alpha-Cubebene (CAS 31141-66-9) 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.
(1R,5S,6R,7S,10R)-4,10-dimethyl-7-propan-2-yltricyclo[4.4.0.01,5]dec-3-ene
Also Known As: alpha-Cubebene, (-)-alpha-Cubebene, Cubebene, alpha-cubeben, alpha-cubenene
| Molecular Formula | C15H24 |
|---|---|
| Molecular Weight | 204.19 g/mol |
| LogP | 4.5 |
| Topological Polar Surface Area | 0.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 0 |
| Rotatable Bonds | 1 |
| Exact Mass | 204.1878 |
| Heavy Atoms | 15 |
| Complexity | 312.0 |
Chemical Identifiers
| CAS Number | 31141-66-9 |
|---|---|
| SMILES | C[C@@H]1CC[C@H]([C@H]2[C@]13[C@@H]2C(=CC3)C)C(C)C |
| InChIKey | XUEHVOLRMXNRKQ-KHMAMNHCSA-N |
Patent-Derived Application Labels
Derived from 6 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
alpha-Cubebene (CAS 31141-66-9), with molecular formula C15H24 and molecular weight 204.19 g/mol. IUPAC: (1R,5S,6R,7S,10R)-4,10-dimethyl-7-propan-2-yltricyclo[4.4.0.01,5]dec-3-ene.
Chemical Property Profile of alpha-Cubebene
Property Insights of alpha-Cubebene
The XLogP value of 4.5 indicates that alpha-Cubebene is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 0.0 Ų, alpha-Cubebene exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, alpha-Cubebene 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 alpha-Cubebene?
The CAS number of alpha-Cubebene is 31141-66-9.
What is the molecular formula of alpha-Cubebene?
The molecular formula of alpha-Cubebene is C15H24.
What is the molecular weight of alpha-Cubebene?
The molecular weight of alpha-Cubebene is 204.19 g/mol.
Where can I buy alpha-Cubebene?
You can request a quote for alpha-Cubebene directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for alpha-Cubebene?
Yes, KEHONG BIO provides custom synthesis services for alpha-Cubebene and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.