1,2-Benzenedicarboxylic acid, 4,4'-carbonylbis-, copper(2+) salt (1:2)
TL;DR: 1,2-Benzenedicarboxylic acid, 4,4'-carbonylbis-, copper(2+) salt (1:2) (CAS 68123-45-5) is a chemical compound with molecular formula C17H6Cu2O9 and molecular weight 479.86 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
dicopper;4-(3,4-dicarboxylatobenzoyl)phthalate
Also Known As: Dicupric 4,4'-carbonyldiphthalate, 4,4'-Carbonyldiphthalic acid, dicopper salt, Copper 4,4'-carbonylbisphthalate (2:1), Copper 4,4'-carbonylbisphthalate(2:1), 1,2-Benzenedicarboxylic acid, 4,4'-carbonylbis-, copper(2+) salt (1:2)
| Molecular Formula | C17H6Cu2O9 |
|---|---|
| Molecular Weight | 479.86 g/mol |
| LogP | -3.63 |
| Topological Polar Surface Area | 178.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 2 |
| Exact Mass | 479.86038 |
| Heavy Atoms | 28 |
| Complexity | 552.0 |
Chemical Identifiers
| CAS Number | 68123-45-5 |
|---|---|
| SMILES | C1=CC(=C(C=C1C(=O)C2=CC(=C(C=C2)C(=O)[O-])C(=O)[O-])C(=O)[O-])C(=O)[O-].[Cu+2].[Cu+2] |
| InChIKey | VAJBYHXALLDCQI-UHFFFAOYSA-J |
Product Overview
1,2-Benzenedicarboxylic acid, 4,4'-carbonylbis-, copper(2+) salt (1:2) (CAS 68123-45-5), with molecular formula C17H6Cu2O9 and molecular weight 479.86 g/mol. IUPAC: dicopper;4-(3,4-dicarboxylatobenzoyl)phthalate.
Chemical Property Profile of 1,2-Benzenedicarboxylic acid, 4,4'-carbonylbis-, copper(2+) salt (1:2)
Property Insights of 1,2-Benzenedicarboxylic acid, 4,4'-carbonylbis-, copper(2+) salt (1:2)
The XLogP value of -3.63 indicates that 1,2-Benzenedicarboxylic acid, 4,4'-carbonylbis-, copper(2+) salt (1:2) is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 178.0 Ų indicates high polarity, suggesting 1,2-Benzenedicarboxylic acid, 4,4'-carbonylbis-, copper(2+) salt (1:2) may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 1,2-Benzenedicarboxylic acid, 4,4'-carbonylbis-, copper(2+) salt (1:2) has 0 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-, copper(2+) salt (1:2)?
The CAS number of 1,2-Benzenedicarboxylic acid, 4,4'-carbonylbis-, copper(2+) salt (1:2) is 68123-45-5.
What is the molecular formula of 1,2-Benzenedicarboxylic acid, 4,4'-carbonylbis-, copper(2+) salt (1:2)?
The molecular formula of 1,2-Benzenedicarboxylic acid, 4,4'-carbonylbis-, copper(2+) salt (1:2) is C17H6Cu2O9.
What is the molecular weight of 1,2-Benzenedicarboxylic acid, 4,4'-carbonylbis-, copper(2+) salt (1:2)?
The molecular weight of 1,2-Benzenedicarboxylic acid, 4,4'-carbonylbis-, copper(2+) salt (1:2) is 479.86 g/mol.
Where can I buy 1,2-Benzenedicarboxylic acid, 4,4'-carbonylbis-, copper(2+) salt (1:2)?
You can request a quote for 1,2-Benzenedicarboxylic acid, 4,4'-carbonylbis-, copper(2+) salt (1:2) 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-, copper(2+) salt (1:2)?
Yes, KEHONG BIO provides custom synthesis services for 1,2-Benzenedicarboxylic acid, 4,4'-carbonylbis-, copper(2+) salt (1:2) and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.