cis-beta-Copaene
TL;DR: cis-beta-Copaene (CAS 18612-33-4) 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,2S,8S)-1-methyl-3-methylidene-8-propan-2-yltricyclo[4.4.0.02,7]decane
Also Known As: .beta.-Copaene, cis-beta-Copaene, beta-Copaene, cis-.beta.-Copaene, (-)-
| Molecular Formula | C15H24 |
|---|---|
| Molecular Weight | 204.19 g/mol |
| LogP | 4.7 |
| 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 | 301.0 |
Chemical Identifiers
| CAS Number | 18612-33-4 |
|---|---|
| SMILES | CC(C)[C@@H]1CC[C@]2([C@H]3C1C2CCC3=C)C |
| InChIKey | UPVZPMJSRSWJHQ-HTXSYXIBSA-N |
Product Overview
cis-beta-Copaene (CAS 18612-33-4), with molecular formula C15H24 and molecular weight 204.19 g/mol. IUPAC: (1R,2S,8S)-1-methyl-3-methylidene-8-propan-2-yltricyclo[4.4.0.02,7]decane.
Chemical Property Profile of cis-beta-Copaene
Property Insights of cis-beta-Copaene
The XLogP value of 4.7 indicates that cis-beta-Copaene is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 0.0 Ų, cis-beta-Copaene exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, cis-beta-Copaene 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 cis-beta-Copaene?
The CAS number of cis-beta-Copaene is 18612-33-4.
What is the molecular formula of cis-beta-Copaene?
The molecular formula of cis-beta-Copaene is C15H24.
What is the molecular weight of cis-beta-Copaene?
The molecular weight of cis-beta-Copaene is 204.19 g/mol.
Where can I buy cis-beta-Copaene?
You can request a quote for cis-beta-Copaene directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for cis-beta-Copaene?
Yes, KEHONG BIO provides custom synthesis services for cis-beta-Copaene and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.