6-Oxabicyclo(3.1.1)heptane-2,3-dicarboxylic acid, disodium salt
TL;DR: 6-Oxabicyclo(3.1.1)heptane-2,3-dicarboxylic acid, disodium salt (CAS 64425-98-5) is a chemical compound with molecular formula C8H8Na2O5 and molecular weight 230.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
disodium;6-oxabicyclo[3.1.1]heptane-2,3-dicarboxylate
Also Known As: 6-Oxabicyclo(3.1.1)heptane-2,3-dicarboxylic acid, disodium salt, disodium 6-oxabicyclo[3.1.1]heptane-2,3-dicarboxylate, disodium 6-oxabicyclo[3.1.1]heptane-3,4-dicarboxylate, 6-Oxabicyclo[3.1.1]heptane-2,3-dicarboxylic acid, disodium salt
| Molecular Formula | C8H8Na2O5 |
|---|---|
| Molecular Weight | 230.02 g/mol |
| LogP | -8.7122 |
| Topological Polar Surface Area | 89.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 0 |
| Exact Mass | 230.01671 |
| Heavy Atoms | 15 |
| Complexity | 250.0 |
Chemical Identifiers
| CAS Number | 64425-98-5 |
|---|---|
| SMILES | C1C2CC(O2)C(C1C(=O)[O-])C(=O)[O-].[Na+].[Na+] |
| InChIKey | XYUYVTOKSVEJHH-UHFFFAOYSA-L |
Product Overview
6-Oxabicyclo(3.1.1)heptane-2,3-dicarboxylic acid, disodium salt (CAS 64425-98-5), with molecular formula C8H8Na2O5 and molecular weight 230.02 g/mol. IUPAC: disodium;6-oxabicyclo[3.1.1]heptane-2,3-dicarboxylate.
Chemical Property Profile of 6-Oxabicyclo(3.1.1)heptane-2,3-dicarboxylic acid, disodium salt
Property Insights of 6-Oxabicyclo(3.1.1)heptane-2,3-dicarboxylic acid, disodium salt
The XLogP value of -8.7122 indicates that 6-Oxabicyclo(3.1.1)heptane-2,3-dicarboxylic acid, disodium salt is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 89.5 Ų falls within the moderate polarity range, balancing permeability and solubility for 6-Oxabicyclo(3.1.1)heptane-2,3-dicarboxylic acid, disodium salt. Following Lipinski's Rule of Five, 6-Oxabicyclo(3.1.1)heptane-2,3-dicarboxylic acid, disodium salt has 0 hydrogen bond donor(s) and 5 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 6-Oxabicyclo(3.1.1)heptane-2,3-dicarboxylic acid, disodium salt?
The CAS number of 6-Oxabicyclo(3.1.1)heptane-2,3-dicarboxylic acid, disodium salt is 64425-98-5.
What is the molecular formula of 6-Oxabicyclo(3.1.1)heptane-2,3-dicarboxylic acid, disodium salt?
The molecular formula of 6-Oxabicyclo(3.1.1)heptane-2,3-dicarboxylic acid, disodium salt is C8H8Na2O5.
What is the molecular weight of 6-Oxabicyclo(3.1.1)heptane-2,3-dicarboxylic acid, disodium salt?
The molecular weight of 6-Oxabicyclo(3.1.1)heptane-2,3-dicarboxylic acid, disodium salt is 230.02 g/mol.
Where can I buy 6-Oxabicyclo(3.1.1)heptane-2,3-dicarboxylic acid, disodium salt?
You can request a quote for 6-Oxabicyclo(3.1.1)heptane-2,3-dicarboxylic acid, disodium salt directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 6-Oxabicyclo(3.1.1)heptane-2,3-dicarboxylic acid, disodium salt?
Yes, KEHONG BIO provides custom synthesis services for 6-Oxabicyclo(3.1.1)heptane-2,3-dicarboxylic acid, disodium salt and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.