1,2-Benzenedicarboxylic acid, 4,4'-carbonylbis-, potassium salt (1:3)
TL;DR: 1,2-Benzenedicarboxylic acid, 4,4'-carbonylbis-, potassium salt (1:3) (CAS 68226-90-4) is a chemical compound with molecular formula C17H7K3O9 and molecular weight 471.90 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
tripotassium;4-(4-carboxy-3-carboxylatobenzoyl)phthalate
Also Known As: Tripotassium 4,4'-carbonyldiphthalate, Tripotassium hydrogen 4,4'-carbonylbisphthalate, tripotassiumhydrogen4,4'-carbonylbisphthalate, potassium hydrogen 4,4'-carbonyldiphthalate(3:1:1), 1,2-Benzenedicarboxylic acid, 4,4'-carbonylbis-, potassium salt (1:3)
| Molecular Formula | C17H7K3O9 |
|---|---|
| Molecular Weight | 471.90 g/mol |
| LogP | -11.28 |
| Topological Polar Surface Area | 175.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 3 |
| Exact Mass | 471.90012 |
| Heavy Atoms | 29 |
| Complexity | 609.0 |
Chemical Identifiers
| CAS Number | 68226-90-4 |
|---|---|
| SMILES | C1=CC(=C(C=C1C(=O)C2=CC(=C(C=C2)C(=O)[O-])C(=O)[O-])C(=O)[O-])C(=O)O.[K+].[K+].[K+] |
| InChIKey | COHGWCHNMXQLHV-UHFFFAOYSA-K |
Product Overview
1,2-Benzenedicarboxylic acid, 4,4'-carbonylbis-, potassium salt (1:3) (CAS 68226-90-4), with molecular formula C17H7K3O9 and molecular weight 471.90 g/mol. IUPAC: tripotassium;4-(4-carboxy-3-carboxylatobenzoyl)phthalate.
Chemical Property Profile of 1,2-Benzenedicarboxylic acid, 4,4'-carbonylbis-, potassium salt (1:3)
Property Insights of 1,2-Benzenedicarboxylic acid, 4,4'-carbonylbis-, potassium salt (1:3)
The XLogP value of -11.28 indicates that 1,2-Benzenedicarboxylic acid, 4,4'-carbonylbis-, potassium salt (1:3) is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 175.0 Ų indicates high polarity, suggesting 1,2-Benzenedicarboxylic acid, 4,4'-carbonylbis-, potassium salt (1:3) may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 1,2-Benzenedicarboxylic acid, 4,4'-carbonylbis-, potassium salt (1:3) has 1 hydrogen bond donor(s) and 9 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 1,2-Benzenedicarboxylic acid, 4,4'-carbonylbis-, potassium salt (1:3)?
The CAS number of 1,2-Benzenedicarboxylic acid, 4,4'-carbonylbis-, potassium salt (1:3) is 68226-90-4.
What is the molecular formula of 1,2-Benzenedicarboxylic acid, 4,4'-carbonylbis-, potassium salt (1:3)?
The molecular formula of 1,2-Benzenedicarboxylic acid, 4,4'-carbonylbis-, potassium salt (1:3) is C17H7K3O9.
What is the molecular weight of 1,2-Benzenedicarboxylic acid, 4,4'-carbonylbis-, potassium salt (1:3)?
The molecular weight of 1,2-Benzenedicarboxylic acid, 4,4'-carbonylbis-, potassium salt (1:3) is 471.90 g/mol.
Where can I buy 1,2-Benzenedicarboxylic acid, 4,4'-carbonylbis-, potassium salt (1:3)?
You can request a quote for 1,2-Benzenedicarboxylic acid, 4,4'-carbonylbis-, potassium salt (1:3) directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1,2-Benzenedicarboxylic acid, 4,4'-carbonylbis-, potassium salt (1:3)?
Yes, KEHONG BIO provides custom synthesis services for 1,2-Benzenedicarboxylic acid, 4,4'-carbonylbis-, potassium salt (1:3) and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.