Hexahydro-2,5-methanopentalene-3a(1H)-carboxylic acid
TL;DR: Hexahydro-2,5-methanopentalene-3a(1H)-carboxylic acid (CAS 16200-53-6) is a chemical compound with molecular formula C10H14O2 and molecular weight 166.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
tricyclo[3.3.1.03,7]nonane-3-carboxylic acid
Also Known As: 3-Noradamantanecarboxylic acid, 3-Noradamantane carboxylic acid, 3-Carboxynoradamantane, Octahydro-2,5-methanopentalene-3a-carboxylic acid, 3-NoradamantanecarboxylicAcid
| Molecular Formula | C10H14O2 |
|---|---|
| Molecular Weight | 166.10 g/mol |
| LogP | 1.8973 |
| Topological Polar Surface Area | 37.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 1 |
| Exact Mass | 166.09938 |
| Heavy Atoms | 12 |
| Complexity | 232.22313 |
Chemical Identifiers
| CAS Number | 16200-53-6 |
|---|---|
| SMILES | C1C2CC3CC1CC3(C2)C(=O)O |
Product Overview
Hexahydro-2,5-methanopentalene-3a(1H)-carboxylic acid (CAS 16200-53-6), with molecular formula C10H14O2 and molecular weight 166.10 g/mol. IUPAC: tricyclo[3.3.1.03,7]nonane-3-carboxylic acid.
Chemical Property Profile of Hexahydro-2,5-methanopentalene-3a(1H)-carboxylic acid
Property Insights of Hexahydro-2,5-methanopentalene-3a(1H)-carboxylic acid
The XLogP value of 1.8973 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Hexahydro-2,5-methanopentalene-3a(1H)-carboxylic acid. With a topological polar surface area (TPSA) of 37.3 Ų, Hexahydro-2,5-methanopentalene-3a(1H)-carboxylic acid exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Hexahydro-2,5-methanopentalene-3a(1H)-carboxylic acid has 1 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-methanopentalene-3a(1H)-carboxylic acid?
The CAS number of Hexahydro-2,5-methanopentalene-3a(1H)-carboxylic acid is 16200-53-6.
What is the molecular formula of Hexahydro-2,5-methanopentalene-3a(1H)-carboxylic acid?
The molecular formula of Hexahydro-2,5-methanopentalene-3a(1H)-carboxylic acid is C10H14O2.
What is the molecular weight of Hexahydro-2,5-methanopentalene-3a(1H)-carboxylic acid?
The molecular weight of Hexahydro-2,5-methanopentalene-3a(1H)-carboxylic acid is 166.10 g/mol.
Where can I buy Hexahydro-2,5-methanopentalene-3a(1H)-carboxylic acid?
You can request a quote for Hexahydro-2,5-methanopentalene-3a(1H)-carboxylic acid 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-methanopentalene-3a(1H)-carboxylic acid?
Yes, KEHONG BIO provides custom synthesis services for Hexahydro-2,5-methanopentalene-3a(1H)-carboxylic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.