(E)-2-epi-beta-caryophyllene
TL;DR: (E)-2-epi-beta-caryophyllene (CAS 164204-21-1) is a chemical compound with molecular formula C15H24 and molecular weight 204.1878 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(1R,4E,9R)-4,11,11-trimethyl-8-methylidenebicyclo[7.2.0]undec-4-ene
Also Known As: Isocaryophyllene, beta-Humulene, (E)-2-epi-beta-caryophyllene, 9-Epi-beta-caryophyllene, 9-epi-(E)-caryophyllene
Technical Specifications
| Molecular Formula | C15H24 |
| Molecular Weight | 204.1878 g/mol |
| XLogP | 4.4 |
| Topological Polar Surface Area (TPSA) | 0.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 0 |
| Rotatable Bonds | 0 |
| Exact Mass | 204.1878 Da |
| Heavy Atoms | 15 |
| Complexity | 293.0 |
| SMILES | C/C/1=C\CCC(=C)[C@@H]2CC([C@@H]2CC1)(C)C |
| InChIKey | NPNUFJAVOOONJE-QWAJQTJBSA-N |
Chemical Property Profile of (E)-2-epi-beta-caryophyllene
Property Insights of (E)-2-epi-beta-caryophyllene
The XLogP value of 4.4 indicates that (E)-2-epi-beta-caryophyllene is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 0.0 Ų, (E)-2-epi-beta-caryophyllene exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (E)-2-epi-beta-caryophyllene 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
What is the CAS number of (E)-2-epi-beta-caryophyllene?
The CAS number of (E)-2-epi-beta-caryophyllene is 164204-21-1.
What is the molecular formula of (E)-2-epi-beta-caryophyllene?
The molecular formula of (E)-2-epi-beta-caryophyllene is C15H24.
What is the molecular weight of (E)-2-epi-beta-caryophyllene?
The molecular weight of (E)-2-epi-beta-caryophyllene is 204.1878 g/mol.
Where can I buy (E)-2-epi-beta-caryophyllene?
You can request a quote for (E)-2-epi-beta-caryophyllene directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for (E)-2-epi-beta-caryophyllene?
Yes, CoreyChem provides custom synthesis services for (E)-2-epi-beta-caryophyllene and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.