Propane-1,1,3,3-tetracarboxylic acid
TL;DR: Propane-1,1,3,3-tetracarboxylic acid (CAS 4721-45-3) is a chemical compound with molecular formula C7H8O8 and molecular weight 220.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
propane-1,1,3,3-tetracarboxylic acid
Also Known As: propane-1,1,3,3-tetracarboxylic acid, 1,1,3,3-Propanetetracarboxylic acid, propane-1,1,3,3-tetracarboxylic, RefChem:374298
| Molecular Formula | C7H8O8 |
|---|---|
| Molecular Weight | 220.02 g/mol |
| LogP | -0.8 |
| Topological Polar Surface Area | 149.0 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 6 |
| Exact Mass | 220.02191 |
| Heavy Atoms | 15 |
| Complexity | 248.0 |
Chemical Identifiers
| CAS Number | 4721-45-3 |
|---|---|
| SMILES | C(C(C(=O)O)C(=O)O)C(C(=O)O)C(=O)O |
| InChIKey | NJEVMKZODGWUQT-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 16 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Propane-1,1,3,3-tetracarboxylic acid (CAS 4721-45-3), with molecular formula C7H8O8 and molecular weight 220.02 g/mol. IUPAC: propane-1,1,3,3-tetracarboxylic acid.
Chemical Property Profile of Propane-1,1,3,3-tetracarboxylic acid
Property Insights of Propane-1,1,3,3-tetracarboxylic acid
The XLogP value of -0.8 indicates that Propane-1,1,3,3-tetracarboxylic acid is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 149.0 Ų indicates high polarity, suggesting Propane-1,1,3,3-tetracarboxylic acid may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Propane-1,1,3,3-tetracarboxylic acid has 4 hydrogen bond donor(s) and 8 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 Propane-1,1,3,3-tetracarboxylic acid?
The CAS number of Propane-1,1,3,3-tetracarboxylic acid is 4721-45-3.
What is the molecular formula of Propane-1,1,3,3-tetracarboxylic acid?
The molecular formula of Propane-1,1,3,3-tetracarboxylic acid is C7H8O8.
What is the molecular weight of Propane-1,1,3,3-tetracarboxylic acid?
The molecular weight of Propane-1,1,3,3-tetracarboxylic acid is 220.02 g/mol.
Where can I buy Propane-1,1,3,3-tetracarboxylic acid?
You can request a quote for Propane-1,1,3,3-tetracarboxylic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Propane-1,1,3,3-tetracarboxylic acid?
Yes, KEHONG BIO provides custom synthesis services for Propane-1,1,3,3-tetracarboxylic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.