Copaene, (+)-
TL;DR: Copaene, (+)- (CAS 947-59-1) 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.
(1S,2R,6R,7R,8R)-1,3-dimethyl-8-propan-2-yltricyclo[4.4.0.02,7]dec-3-ene
Also Known As: Copaene, (+)-, (+)-alpha-Copaene, 1-Butylpentyl acetate, (+)-.ALPHA.-COPAENE, Tricyclo(4.4.0.02,7)dec-3-ene, 1,3-dimethyl-8-(1-methylethyl)-, (1S,2R,6R,7R,8R)-
| 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 | 947-59-1 |
|---|---|
| SMILES | CC1=CC[C@@H]2[C@@H]3[C@H]1[C@]2(CC[C@@H]3C(C)C)C |
| InChIKey | VLXDPFLIRFYIME-ZSAUSMIDSA-N |
Product Overview
Copaene, (+)- (CAS 947-59-1), with molecular formula C15H24 and molecular weight 204.19 g/mol. IUPAC: (1S,2R,6R,7R,8R)-1,3-dimethyl-8-propan-2-yltricyclo[4.4.0.02,7]dec-3-ene.
Chemical Property Profile of Copaene, (+)-
Property Insights of Copaene, (+)-
The XLogP value of 4.5 indicates that 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, Copaene, (+)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 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 Copaene, (+)-?
The CAS number of Copaene, (+)- is 947-59-1.
What is the molecular formula of Copaene, (+)-?
The molecular formula of Copaene, (+)- is C15H24.
What is the molecular weight of Copaene, (+)-?
The molecular weight of Copaene, (+)- is 204.19 g/mol.
Where can I buy Copaene, (+)-?
You can request a quote for Copaene, (+)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Copaene, (+)-?
Yes, KEHONG BIO provides custom synthesis services for Copaene, (+)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.