(3Ar,4s,5r,7s,7ar)-octahydro-1h-4,7-methanoindene-5-carboxylic acid
TL;DR: (3Ar,4s,5r,7s,7ar)-octahydro-1h-4,7-methanoindene-5-carboxylic acid (CAS 109430-04-8) is a chemical compound with molecular formula C11H16O2 and molecular weight 180.11504 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(1S,2R,6R,7S,8R)-tricyclo[5.2.1.02,6]decane-8-carboxylic acid
Also Known As: KST-1A0833, (3ar,4s,5r,7s,7ar)-octahydro-1h-4,7-methanoindene-5-carboxylic acid, Octahydro-1H-4,7-methanoindene-5-carboxylic acid, 4,7-Methano-1H-indene-5-carboxylic acid, octahydro-, (3aalpha,4alpha,5alpha,7alpha,7aalpha)-, 4,7-Methano-1H-indene-5-carboxylic acid,octahydro-,(3aalpha,4alpha,5alpha,7alpha,7aalpha)
Technical Specifications
| Molecular Formula | C11H16O2 |
| Molecular Weight | 180.11504 g/mol |
| XLogP | 2.6 |
| Topological Polar Surface Area (TPSA) | 37.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 180.11504 Da |
| Heavy Atoms | 13 |
| Complexity | 248.0 |
| SMILES | C1C[C@H]2[C@@H](C1)[C@@H]3C[C@H]2C[C@H]3C(=O)O |
| InChIKey | PLPOOSRONAYTQI-LOLPMWEVSA-N |
Chemical Property Profile of (3Ar,4s,5r,7s,7ar)-octahydro-1h-4,7-methanoindene-5-carboxylic acid
Property Insights of (3Ar,4s,5r,7s,7ar)-octahydro-1h-4,7-methanoindene-5-carboxylic acid
The XLogP value of 2.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (3Ar,4s,5r,7s,7ar)-octahydro-1h-4,7-methanoindene-5-carboxylic acid. With a topological polar surface area (TPSA) of 37.3 Ų, (3Ar,4s,5r,7s,7ar)-octahydro-1h-4,7-methanoindene-5-carboxylic acid exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (3Ar,4s,5r,7s,7ar)-octahydro-1h-4,7-methanoindene-5-carboxylic acid has 1 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of (3Ar,4s,5r,7s,7ar)-octahydro-1h-4,7-methanoindene-5-carboxylic acid?
The CAS number of (3Ar,4s,5r,7s,7ar)-octahydro-1h-4,7-methanoindene-5-carboxylic acid is 109430-04-8.
What is the molecular formula of (3Ar,4s,5r,7s,7ar)-octahydro-1h-4,7-methanoindene-5-carboxylic acid?
The molecular formula of (3Ar,4s,5r,7s,7ar)-octahydro-1h-4,7-methanoindene-5-carboxylic acid is C11H16O2.
What is the molecular weight of (3Ar,4s,5r,7s,7ar)-octahydro-1h-4,7-methanoindene-5-carboxylic acid?
The molecular weight of (3Ar,4s,5r,7s,7ar)-octahydro-1h-4,7-methanoindene-5-carboxylic acid is 180.11504 g/mol.
Where can I buy (3Ar,4s,5r,7s,7ar)-octahydro-1h-4,7-methanoindene-5-carboxylic acid?
You can request a quote for (3Ar,4s,5r,7s,7ar)-octahydro-1h-4,7-methanoindene-5-carboxylic acid directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for (3Ar,4s,5r,7s,7ar)-octahydro-1h-4,7-methanoindene-5-carboxylic acid?
Yes, CoreyChem provides custom synthesis services for (3Ar,4s,5r,7s,7ar)-octahydro-1h-4,7-methanoindene-5-carboxylic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.