cis,cis-6-tert-Butyloctahydronaphthalen-2(1H)-one
TL;DR: cis,cis-6-tert-Butyloctahydronaphthalen-2(1H)-one (CAS 24143-52-0) is a chemical compound with molecular formula C14H24O and molecular weight 208.18271 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
6-tert-butyl-3,4,4a,5,6,7,8,8a-octahydro-1H-naphthalen-2-one
Also Known As: 6-tert-butyloctahydronaphthalen-2(1h)-one, cis-6-tert.-Butyl-trans-decalon-2, cis,cis-6-tert-Butyloctahydronaphthalen-2(1H)-one, 6-tert-butyl-3,4,4a,5,6,7,8,8a-octahydro-1H-naphthalen-2-one, 6alpha-tert-Butyl-3,4,4abeta,5,6,7,8,8abeta-octahydronaphthalen-2(1H)-one
Technical Specifications
| Molecular Formula | C14H24O |
| Molecular Weight | 208.18271 g/mol |
| XLogP | 3.9 |
| Topological Polar Surface Area (TPSA) | 17.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 1 |
| Exact Mass | 208.18271 Da |
| Heavy Atoms | 15 |
| Complexity | 249.0 |
| SMILES | CC(C)(C)C1CCC2CC(=O)CCC2C1 |
| InChIKey | QQKVQRVPUCGGKW-UHFFFAOYSA-N |
Chemical Property Profile of cis,cis-6-tert-Butyloctahydronaphthalen-2(1H)-one
Property Insights of cis,cis-6-tert-Butyloctahydronaphthalen-2(1H)-one
The XLogP value of 3.9 indicates that cis,cis-6-tert-Butyloctahydronaphthalen-2(1H)-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, cis,cis-6-tert-Butyloctahydronaphthalen-2(1H)-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, cis,cis-6-tert-Butyloctahydronaphthalen-2(1H)-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 cis,cis-6-tert-Butyloctahydronaphthalen-2(1H)-one?
The CAS number of cis,cis-6-tert-Butyloctahydronaphthalen-2(1H)-one is 24143-52-0.
What is the molecular formula of cis,cis-6-tert-Butyloctahydronaphthalen-2(1H)-one?
The molecular formula of cis,cis-6-tert-Butyloctahydronaphthalen-2(1H)-one is C14H24O.
What is the molecular weight of cis,cis-6-tert-Butyloctahydronaphthalen-2(1H)-one?
The molecular weight of cis,cis-6-tert-Butyloctahydronaphthalen-2(1H)-one is 208.18271 g/mol.
Where can I buy cis,cis-6-tert-Butyloctahydronaphthalen-2(1H)-one?
You can request a quote for cis,cis-6-tert-Butyloctahydronaphthalen-2(1H)-one directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for cis,cis-6-tert-Butyloctahydronaphthalen-2(1H)-one?
Yes, CoreyChem provides custom synthesis services for cis,cis-6-tert-Butyloctahydronaphthalen-2(1H)-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.