5-Oxotricyclo(2.2.1.0(2,6))heptane-3-carboxylic acid
TL;DR: 5-Oxotricyclo(2.2.1.0(2,6))heptane-3-carboxylic acid (CAS 7139-63-1) is a chemical compound with molecular formula C8H8O3 and molecular weight 152.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-oxotricyclo[2.2.1.02,6]heptane-3-carboxylic acid
Also Known As: oxo[?]carboxylic acid, 5-Oxotricyclo[2.2.1.02,6]heptane-3-carboxylic Acid, 5-Oxotricyclo[2.2.1.0,2,6]heptane-3-carboxylic acid, 5-Oxotricyclo(2.2.1.0(2,6))heptane-3-carboxylic acid, (1R,2S,3S,4S,6R)-5-Oxotricyclo[2.2.1.02,6]heptane-3-carboxylic Acid
| Molecular Formula | C8H8O3 |
|---|---|
| Molecular Weight | 152.05 g/mol |
| LogP | -0.3 |
| Topological Polar Surface Area | 54.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 152.04735 |
| Heavy Atoms | 11 |
| Complexity | 271.0 |
Chemical Identifiers
| CAS Number | 7139-63-1 |
|---|---|
| SMILES | C1C2C3C2C(=O)C1C3C(=O)O |
| InChIKey | YUOZAHBGIJALKD-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 6 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
5-Oxotricyclo(2.2.1.0(2,6))heptane-3-carboxylic acid (CAS 7139-63-1), with molecular formula C8H8O3 and molecular weight 152.05 g/mol. IUPAC: 5-oxotricyclo[2.2.1.02,6]heptane-3-carboxylic acid.
Chemical Property Profile of 5-Oxotricyclo(2.2.1.0(2,6))heptane-3-carboxylic acid
Property Insights of 5-Oxotricyclo(2.2.1.0(2,6))heptane-3-carboxylic acid
The XLogP value of -0.3 indicates that 5-Oxotricyclo(2.2.1.0(2,6))heptane-3-carboxylic acid is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. With a topological polar surface area (TPSA) of 54.4 Ų, 5-Oxotricyclo(2.2.1.0(2,6))heptane-3-carboxylic acid exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 5-Oxotricyclo(2.2.1.0(2,6))heptane-3-carboxylic acid has 1 hydrogen bond donor(s) and 3 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 5-Oxotricyclo(2.2.1.0(2,6))heptane-3-carboxylic acid?
The CAS number of 5-Oxotricyclo(2.2.1.0(2,6))heptane-3-carboxylic acid is 7139-63-1.
What is the molecular formula of 5-Oxotricyclo(2.2.1.0(2,6))heptane-3-carboxylic acid?
The molecular formula of 5-Oxotricyclo(2.2.1.0(2,6))heptane-3-carboxylic acid is C8H8O3.
What is the molecular weight of 5-Oxotricyclo(2.2.1.0(2,6))heptane-3-carboxylic acid?
The molecular weight of 5-Oxotricyclo(2.2.1.0(2,6))heptane-3-carboxylic acid is 152.05 g/mol.
Where can I buy 5-Oxotricyclo(2.2.1.0(2,6))heptane-3-carboxylic acid?
You can request a quote for 5-Oxotricyclo(2.2.1.0(2,6))heptane-3-carboxylic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-Oxotricyclo(2.2.1.0(2,6))heptane-3-carboxylic acid?
Yes, KEHONG BIO provides custom synthesis services for 5-Oxotricyclo(2.2.1.0(2,6))heptane-3-carboxylic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.