1-Isopropyl-4,7-dimethyl-1,2,4a,5,8,8a-hexahydronaphthalene
TL;DR: 1-Isopropyl-4,7-dimethyl-1,2,4a,5,8,8a-hexahydronaphthalene (CAS 5951-61-1) 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.
4,7-dimethyl-1-propan-2-yl-1,2,4a,5,8,8a-hexahydronaphthalene
Also Known As: Dysoxylonene, BETA-CADINENE, CADINENE, (.+/-.)-Cadinene, 1-Isopropyl-4,7-dimethyl-1,2,4a,5,8,8a-hexahydronaphthalene
| Molecular Formula | C15H24 |
|---|---|
| Molecular Weight | 204.19 g/mol |
| LogP | 4.0 |
| 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 | 293.0 |
Chemical Identifiers
| CAS Number | 5951-61-1 |
|---|---|
| SMILES | CC1=CCC2C(C1)C(CC=C2C)C(C)C |
| InChIKey | USDOQCCMRDNVAH-UHFFFAOYSA-N |
Product Overview
1-Isopropyl-4,7-dimethyl-1,2,4a,5,8,8a-hexahydronaphthalene (CAS 5951-61-1), with molecular formula C15H24 and molecular weight 204.19 g/mol. IUPAC: 4,7-dimethyl-1-propan-2-yl-1,2,4a,5,8,8a-hexahydronaphthalene.
Chemical Property Profile of 1-Isopropyl-4,7-dimethyl-1,2,4a,5,8,8a-hexahydronaphthalene
Property Insights of 1-Isopropyl-4,7-dimethyl-1,2,4a,5,8,8a-hexahydronaphthalene
The XLogP value of 4.0 indicates that 1-Isopropyl-4,7-dimethyl-1,2,4a,5,8,8a-hexahydronaphthalene is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 0.0 Ų, 1-Isopropyl-4,7-dimethyl-1,2,4a,5,8,8a-hexahydronaphthalene exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-Isopropyl-4,7-dimethyl-1,2,4a,5,8,8a-hexahydronaphthalene 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 1-Isopropyl-4,7-dimethyl-1,2,4a,5,8,8a-hexahydronaphthalene?
The CAS number of 1-Isopropyl-4,7-dimethyl-1,2,4a,5,8,8a-hexahydronaphthalene is 5951-61-1.
What is the molecular formula of 1-Isopropyl-4,7-dimethyl-1,2,4a,5,8,8a-hexahydronaphthalene?
The molecular formula of 1-Isopropyl-4,7-dimethyl-1,2,4a,5,8,8a-hexahydronaphthalene is C15H24.
What is the molecular weight of 1-Isopropyl-4,7-dimethyl-1,2,4a,5,8,8a-hexahydronaphthalene?
The molecular weight of 1-Isopropyl-4,7-dimethyl-1,2,4a,5,8,8a-hexahydronaphthalene is 204.19 g/mol.
Where can I buy 1-Isopropyl-4,7-dimethyl-1,2,4a,5,8,8a-hexahydronaphthalene?
You can request a quote for 1-Isopropyl-4,7-dimethyl-1,2,4a,5,8,8a-hexahydronaphthalene directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-Isopropyl-4,7-dimethyl-1,2,4a,5,8,8a-hexahydronaphthalene?
Yes, KEHONG BIO provides custom synthesis services for 1-Isopropyl-4,7-dimethyl-1,2,4a,5,8,8a-hexahydronaphthalene and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.