4a,5-Dimethyl-3-propan-2-yl-2,3,4,5,6,7,8,8a-octahydronaphthalen-1-one
TL;DR: 4a,5-Dimethyl-3-propan-2-yl-2,3,4,5,6,7,8,8a-octahydronaphthalen-1-one (CAS 55332-02-0) is a chemical compound with molecular formula C15H26O and molecular weight 222.19836 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
4a,5-dimethyl-3-propan-2-yl-2,3,4,5,6,7,8,8a-octahydronaphthalen-1-one
Also Known As: J1.842.725G, 3-Isopropyl-4a,5-dimethyldecahydronaphthalene-1-one, 4a,5-dimethyl-3-propan-2-yl-2,3,4,5,6,7,8,8a-octahydronaphthalen-1-one, 4a,5-dimethyl-3-(propan-2-yl)-decahydronaphthalen-1-one, 4a,5-Dimethyl-3-(propan-2-yl)octahydronaphthalen-1(2H)-one
Technical Specifications
| Molecular Formula | C15H26O |
| Molecular Weight | 222.19836 g/mol |
| XLogP | 4.5 |
| Topological Polar Surface Area (TPSA) | 17.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 1 |
| Exact Mass | 222.19836 Da |
| Heavy Atoms | 16 |
| Complexity | 281.0 |
| SMILES | CC1CCCC2C1(CC(CC2=O)C(C)C)C |
| InChIKey | XWJOSENQVBWBGM-UHFFFAOYSA-N |
Chemical Property Profile of 4a,5-Dimethyl-3-propan-2-yl-2,3,4,5,6,7,8,8a-octahydronaphthalen-1-one
Property Insights of 4a,5-Dimethyl-3-propan-2-yl-2,3,4,5,6,7,8,8a-octahydronaphthalen-1-one
The XLogP value of 4.5 indicates that 4a,5-Dimethyl-3-propan-2-yl-2,3,4,5,6,7,8,8a-octahydronaphthalen-1-one is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 17.1 Ų, 4a,5-Dimethyl-3-propan-2-yl-2,3,4,5,6,7,8,8a-octahydronaphthalen-1-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4a,5-Dimethyl-3-propan-2-yl-2,3,4,5,6,7,8,8a-octahydronaphthalen-1-one has 0 hydrogen bond donor(s) and 1 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of 4a,5-Dimethyl-3-propan-2-yl-2,3,4,5,6,7,8,8a-octahydronaphthalen-1-one?
The CAS number of 4a,5-Dimethyl-3-propan-2-yl-2,3,4,5,6,7,8,8a-octahydronaphthalen-1-one is 55332-02-0.
What is the molecular formula of 4a,5-Dimethyl-3-propan-2-yl-2,3,4,5,6,7,8,8a-octahydronaphthalen-1-one?
The molecular formula of 4a,5-Dimethyl-3-propan-2-yl-2,3,4,5,6,7,8,8a-octahydronaphthalen-1-one is C15H26O.
What is the molecular weight of 4a,5-Dimethyl-3-propan-2-yl-2,3,4,5,6,7,8,8a-octahydronaphthalen-1-one?
The molecular weight of 4a,5-Dimethyl-3-propan-2-yl-2,3,4,5,6,7,8,8a-octahydronaphthalen-1-one is 222.19836 g/mol.
Where can I buy 4a,5-Dimethyl-3-propan-2-yl-2,3,4,5,6,7,8,8a-octahydronaphthalen-1-one?
You can request a quote for 4a,5-Dimethyl-3-propan-2-yl-2,3,4,5,6,7,8,8a-octahydronaphthalen-1-one directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 4a,5-Dimethyl-3-propan-2-yl-2,3,4,5,6,7,8,8a-octahydronaphthalen-1-one?
Yes, CoreyChem provides custom synthesis services for 4a,5-Dimethyl-3-propan-2-yl-2,3,4,5,6,7,8,8a-octahydronaphthalen-1-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.