Bergamotene
TL;DR: Bergamotene (CAS 6895-56-3) 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.
6-methyl-2-methylidene-6-(4-methylpent-3-enyl)bicyclo[3.1.1]heptane
Also Known As: Bergamotene, beta-Bergamotene, beta-trans-bergamotene, .beta.-trans-Bergamotene, trans-.beta.-Bergamotene
| Molecular Formula | C15H24 |
|---|---|
| Molecular Weight | 204.19 g/mol |
| LogP | 5.1 |
| Topological Polar Surface Area | 0.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 0 |
| Rotatable Bonds | 3 |
| Exact Mass | 204.1878 |
| Heavy Atoms | 15 |
| Complexity | 293.0 |
Chemical Identifiers
| CAS Number | 6895-56-3 |
|---|---|
| SMILES | CC(=CCCC1(C2CCC(=C)C1C2)C)C |
| InChIKey | DGZBGCMPRYFWFF-UHFFFAOYSA-N |
Product Overview
Bergamotene (CAS 6895-56-3), with molecular formula C15H24 and molecular weight 204.19 g/mol. IUPAC: 6-methyl-2-methylidene-6-(4-methylpent-3-enyl)bicyclo[3.1.1]heptane.
Chemical Property Profile of Bergamotene
Property Insights of Bergamotene
The XLogP value of 5.1 indicates that Bergamotene is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 0.0 Ų, Bergamotene exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Bergamotene has 0 hydrogen bond donor(s) and 0 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Bergamotene?
The CAS number of Bergamotene is 6895-56-3.
What is the molecular formula of Bergamotene?
The molecular formula of Bergamotene is C15H24.
What is the molecular weight of Bergamotene?
The molecular weight of Bergamotene is 204.19 g/mol.
Where can I buy Bergamotene?
You can request a quote for Bergamotene directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Bergamotene?
Yes, KEHONG BIO provides custom synthesis services for Bergamotene and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.