3,4-Dihydrocadalene
TL;DR: 3,4-Dihydrocadalene (CAS 77129-50-1) is a chemical compound with molecular formula C15H20 and molecular weight 200.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4,7-dimethyl-1-propan-2-yl-1,2-dihydronaphthalene
Also Known As: 3,4-Dihydrocadalene, Calacorene, alpha-corocalen, alpha-colocarene, (E)-Calacorene
| Molecular Formula | C15H20 |
|---|---|
| Molecular Weight | 200.16 g/mol |
| LogP | 4.4 |
| Topological Polar Surface Area | 0.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 0 |
| Rotatable Bonds | 1 |
| Exact Mass | 200.1565 |
| Heavy Atoms | 15 |
| Complexity | 249.0 |
Chemical Identifiers
| CAS Number | 77129-50-1 |
|---|---|
| SMILES | CC1=CCC(C2=C1C=CC(=C2)C)C(C)C |
| InChIKey | CUUMXRBKJIDIAY-UHFFFAOYSA-N |
Product Overview
3,4-Dihydrocadalene (CAS 77129-50-1), with molecular formula C15H20 and molecular weight 200.16 g/mol. IUPAC: 4,7-dimethyl-1-propan-2-yl-1,2-dihydronaphthalene.
Chemical Property Profile of 3,4-Dihydrocadalene
Property Insights of 3,4-Dihydrocadalene
The XLogP value of 4.4 indicates that 3,4-Dihydrocadalene is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 0.0 Ų, 3,4-Dihydrocadalene exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3,4-Dihydrocadalene 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 3,4-Dihydrocadalene?
The CAS number of 3,4-Dihydrocadalene is 77129-50-1.
What is the molecular formula of 3,4-Dihydrocadalene?
The molecular formula of 3,4-Dihydrocadalene is C15H20.
What is the molecular weight of 3,4-Dihydrocadalene?
The molecular weight of 3,4-Dihydrocadalene is 200.16 g/mol.
Where can I buy 3,4-Dihydrocadalene?
You can request a quote for 3,4-Dihydrocadalene directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3,4-Dihydrocadalene?
Yes, KEHONG BIO provides custom synthesis services for 3,4-Dihydrocadalene and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.