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2-oxohexahydro-2H-3,5-methanocyclopenta[b]furan-7-carboxylic acid
TL;DR: 2-oxohexahydro-2H-3,5-methanocyclopenta[b]furan-7-carboxylic acid (CAS 623-60-9) is a chemical compound with molecular formula C9H10O4 and molecular weight 182.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-oxo-4-oxatricyclo[4.2.1.03,7]nonane-9-carboxylic acid
Also Known As: oxo[?]carboxylic acid, 3, hexahydro-2-oxo-, stereoisomer, 2-oxohexahydro-2H-3,5-methanocyclopenta[b]furan-7-carboxylic acid, 5-oxo-4-oxatricyclo[4.2.1.03,7]nonane-9-carboxylic acid, NORBORNANEDICARBOXYLIC ACID, Y-LACTONE
| Molecular Formula | C9H10O4 |
|---|---|
| Molecular Weight | 182.06 g/mol |
| LogP | 0.2 |
| Topological Polar Surface Area | 63.6 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 1 |
| Exact Mass | 182.0579 |
| Heavy Atoms | 13 |
| Complexity | 298.0 |
Chemical Identifiers
| CAS Number | 623-60-9 |
|---|---|
| SMILES | C1C2CC3C1C(C2C(=O)O)C(=O)O3 |
| InChIKey | HAQPSNHNVBEWRO-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2-oxohexahydro-2H-3,5-methanocyclopenta[b]furan-7-carboxylic acid (CAS 623-60-9), with molecular formula C9H10O4 and molecular weight 182.06 g/mol. IUPAC: 5-oxo-4-oxatricyclo[4.2.1.03,7]nonane-9-carboxylic acid.
Chemical Property Profile of 2-oxohexahydro-2H-3,5-methanocyclopenta[b]furan-7-carboxylic acid
Property Insights of 2-oxohexahydro-2H-3,5-methanocyclopenta[b]furan-7-carboxylic acid
The XLogP value of 0.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-oxohexahydro-2H-3,5-methanocyclopenta[b]furan-7-carboxylic acid. The TPSA of 63.6 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-oxohexahydro-2H-3,5-methanocyclopenta[b]furan-7-carboxylic acid. Following Lipinski's Rule of Five, 2-oxohexahydro-2H-3,5-methanocyclopenta[b]furan-7-carboxylic acid has 1 hydrogen bond donor(s) and 4 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 2-oxohexahydro-2H-3,5-methanocyclopenta[b]furan-7-carboxylic acid?
The CAS number of 2-oxohexahydro-2H-3,5-methanocyclopenta[b]furan-7-carboxylic acid is 623-60-9.
What is the molecular formula of 2-oxohexahydro-2H-3,5-methanocyclopenta[b]furan-7-carboxylic acid?
The molecular formula of 2-oxohexahydro-2H-3,5-methanocyclopenta[b]furan-7-carboxylic acid is C9H10O4.
What is the molecular weight of 2-oxohexahydro-2H-3,5-methanocyclopenta[b]furan-7-carboxylic acid?
The molecular weight of 2-oxohexahydro-2H-3,5-methanocyclopenta[b]furan-7-carboxylic acid is 182.06 g/mol.
Where can I buy 2-oxohexahydro-2H-3,5-methanocyclopenta[b]furan-7-carboxylic acid?
You can request a quote for 2-oxohexahydro-2H-3,5-methanocyclopenta[b]furan-7-carboxylic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-oxohexahydro-2H-3,5-methanocyclopenta[b]furan-7-carboxylic acid?
Yes, KEHONG BIO provides custom synthesis services for 2-oxohexahydro-2H-3,5-methanocyclopenta[b]furan-7-carboxylic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.