Thujopsene-I3
TL;DR: Thujopsene-I3 (CAS 38609-30-2) 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.
2,2,3,7-tetramethyltricyclo[5.2.2.01,6]undec-3-ene
Also Known As: Thujopsene-I3, 2,2,3,7-Tetramethyltricyclo[5.2.2.01,6]undec-3-ene, 1,4,4,5-tetramethyl-1,2,3,4,7,7a-hexahydro-1,3a-ethanoindene
| Molecular Formula | C15H24 |
|---|---|
| Molecular Weight | 204.19 g/mol |
| LogP | 4.9 |
| Topological Polar Surface Area | 0.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 0 |
| Rotatable Bonds | 0 |
| Exact Mass | 204.1878 |
| Heavy Atoms | 15 |
| Complexity | 324.0 |
Chemical Identifiers
| CAS Number | 38609-30-2 |
|---|---|
| SMILES | CC1=CCC2C3(CCC2(C1(C)C)CC3)C |
| InChIKey | STZAKYAXVXYXMC-UHFFFAOYSA-N |
Product Overview
Thujopsene-I3 (CAS 38609-30-2), with molecular formula C15H24 and molecular weight 204.19 g/mol. IUPAC: 2,2,3,7-tetramethyltricyclo[5.2.2.01,6]undec-3-ene.
Chemical Property Profile of Thujopsene-I3
Property Insights of Thujopsene-I3
The XLogP value of 4.9 indicates that Thujopsene-I3 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 0.0 Ų, Thujopsene-I3 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Thujopsene-I3 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 Thujopsene-I3?
The CAS number of Thujopsene-I3 is 38609-30-2.
What is the molecular formula of Thujopsene-I3?
The molecular formula of Thujopsene-I3 is C15H24.
What is the molecular weight of Thujopsene-I3?
The molecular weight of Thujopsene-I3 is 204.19 g/mol.
Where can I buy Thujopsene-I3?
You can request a quote for Thujopsene-I3 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Thujopsene-I3?
Yes, KEHONG BIO provides custom synthesis services for Thujopsene-I3 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.