4,7-Methano-1H-inden-1-one, 2,3,3a,4,7,7a-hexahydro-
TL;DR: 4,7-Methano-1H-inden-1-one, 2,3,3a,4,7,7a-hexahydro- (CAS 86105-40-0) is a chemical compound with molecular formula C10H12O and molecular weight 148.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
tricyclo[5.2.1.02,6]dec-8-en-3-one
Also Known As: NCIOpen2_001470, 4,7-Methano-1H-inden-1-one, 2,3,3a,4,7,7a-hexahydro-, tricyclo[5.2.1.02,6]dec-8-en-3-one, J1.058.187G, Tricyclo[5.2.1.02,6]decane-8-ene-3-one
| Molecular Formula | C10H12O |
|---|---|
| Molecular Weight | 148.09 g/mol |
| LogP | 1.4 |
| Topological Polar Surface Area | 17.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 0 |
| Exact Mass | 148.08882 |
| Heavy Atoms | 11 |
| Complexity | 241.0 |
Chemical Identifiers
| CAS Number | 86105-40-0 |
|---|---|
| SMILES | C1CC(=O)C2C1C3CC2C=C3 |
| InChIKey | NDZKBCKGQBZZFM-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
4,7-Methano-1H-inden-1-one, 2,3,3a,4,7,7a-hexahydro- (CAS 86105-40-0), with molecular formula C10H12O and molecular weight 148.09 g/mol. IUPAC: tricyclo[5.2.1.02,6]dec-8-en-3-one.
Chemical Property Profile of 4,7-Methano-1H-inden-1-one, 2,3,3a,4,7,7a-hexahydro-
Property Insights of 4,7-Methano-1H-inden-1-one, 2,3,3a,4,7,7a-hexahydro-
The XLogP value of 1.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4,7-Methano-1H-inden-1-one, 2,3,3a,4,7,7a-hexahydro-. With a topological polar surface area (TPSA) of 17.1 Ų, 4,7-Methano-1H-inden-1-one, 2,3,3a,4,7,7a-hexahydro- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4,7-Methano-1H-inden-1-one, 2,3,3a,4,7,7a-hexahydro- 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 4,7-Methano-1H-inden-1-one, 2,3,3a,4,7,7a-hexahydro-?
The CAS number of 4,7-Methano-1H-inden-1-one, 2,3,3a,4,7,7a-hexahydro- is 86105-40-0.
What is the molecular formula of 4,7-Methano-1H-inden-1-one, 2,3,3a,4,7,7a-hexahydro-?
The molecular formula of 4,7-Methano-1H-inden-1-one, 2,3,3a,4,7,7a-hexahydro- is C10H12O.
What is the molecular weight of 4,7-Methano-1H-inden-1-one, 2,3,3a,4,7,7a-hexahydro-?
The molecular weight of 4,7-Methano-1H-inden-1-one, 2,3,3a,4,7,7a-hexahydro- is 148.09 g/mol.
Where can I buy 4,7-Methano-1H-inden-1-one, 2,3,3a,4,7,7a-hexahydro-?
You can request a quote for 4,7-Methano-1H-inden-1-one, 2,3,3a,4,7,7a-hexahydro- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4,7-Methano-1H-inden-1-one, 2,3,3a,4,7,7a-hexahydro-?
Yes, KEHONG BIO provides custom synthesis services for 4,7-Methano-1H-inden-1-one, 2,3,3a,4,7,7a-hexahydro- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.