Hexahydro-2,5,5-trimethyl-2H-2,4a-methanonaphthalen-1(5H)-one
TL;DR: Hexahydro-2,5,5-trimethyl-2H-2,4a-methanonaphthalen-1(5H)-one (CAS 77925-50-9) is a chemical compound with molecular formula C14H22O and molecular weight 206.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2,2,6-trimethyl-octahydro-1H-2,4a-methanonapthalen-8-one
Also Known As: EINECS 278-794-5, Hexahydro-2,5,5-trimethyl-2H-2,4a-methanonaphthalen-1(5H)-one, 2,2,8-trimethyltricyclo[6.2.1.01,6]undecan-7-one, 2,2,6-trimethyl-octahydro-1H-2,4a-methanonapthalene-8-one, 2,5,5-Trimethylhexahydro-2H-2,4a-methanonaphthalen-1(5H)-one
| Molecular Formula | C14H22O |
|---|---|
| Molecular Weight | 206.17 g/mol |
| LogP | 3.572 |
| Topological Polar Surface Area | 17.07 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 0 |
| Exact Mass | 206.16707 |
| Heavy Atoms | 15 |
| Complexity | 330.2304 |
Chemical Identifiers
| CAS Number | 77925-50-9 |
|---|---|
| SMILES | CC1(CCCC2C13CCC(C3)(C2=O)C)C |
Product Overview
Hexahydro-2,5,5-trimethyl-2H-2,4a-methanonaphthalen-1(5H)-one (CAS 77925-50-9), with molecular formula C14H22O and molecular weight 206.17 g/mol. IUPAC: 2,2,6-trimethyl-octahydro-1H-2,4a-methanonapthalen-8-one.
Chemical Property Profile of Hexahydro-2,5,5-trimethyl-2H-2,4a-methanonaphthalen-1(5H)-one
Property Insights of Hexahydro-2,5,5-trimethyl-2H-2,4a-methanonaphthalen-1(5H)-one
The XLogP value of 3.572 indicates that Hexahydro-2,5,5-trimethyl-2H-2,4a-methanonaphthalen-1(5H)-one is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 17.07 Ų, Hexahydro-2,5,5-trimethyl-2H-2,4a-methanonaphthalen-1(5H)-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Hexahydro-2,5,5-trimethyl-2H-2,4a-methanonaphthalen-1(5H)-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
Frequently Asked Questions
What is the CAS number of Hexahydro-2,5,5-trimethyl-2H-2,4a-methanonaphthalen-1(5H)-one?
The CAS number of Hexahydro-2,5,5-trimethyl-2H-2,4a-methanonaphthalen-1(5H)-one is 77925-50-9.
What is the molecular formula of Hexahydro-2,5,5-trimethyl-2H-2,4a-methanonaphthalen-1(5H)-one?
The molecular formula of Hexahydro-2,5,5-trimethyl-2H-2,4a-methanonaphthalen-1(5H)-one is C14H22O.
What is the molecular weight of Hexahydro-2,5,5-trimethyl-2H-2,4a-methanonaphthalen-1(5H)-one?
The molecular weight of Hexahydro-2,5,5-trimethyl-2H-2,4a-methanonaphthalen-1(5H)-one is 206.17 g/mol.
Where can I buy Hexahydro-2,5,5-trimethyl-2H-2,4a-methanonaphthalen-1(5H)-one?
You can request a quote for Hexahydro-2,5,5-trimethyl-2H-2,4a-methanonaphthalen-1(5H)-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Hexahydro-2,5,5-trimethyl-2H-2,4a-methanonaphthalen-1(5H)-one?
Yes, KEHONG BIO provides custom synthesis services for Hexahydro-2,5,5-trimethyl-2H-2,4a-methanonaphthalen-1(5H)-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.