1,2-Benzenedicarboxylic acid, 1-butyl ester, copper(2+) salt (2:1)
TL;DR: 1,2-Benzenedicarboxylic acid, 1-butyl ester, copper(2+) salt (2:1) (CAS 5423-38-1) is a chemical compound with molecular formula C24H26CuO8 and molecular weight 505.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
copper bis(2-butoxycarbonylbenzoate)
Also Known As: Copper dibutyl diphthalate, Copper(2+) monobutyl phthalate, Butyl phthalate, copper salt, copper;2-butoxycarbonylbenzoate, copper 2-butoxycarbonylbenzoate
| Molecular Formula | C24H26CuO8 |
|---|---|
| Molecular Weight | 505.09 g/mol |
| LogP | 2.01 |
| Topological Polar Surface Area | 133.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 10 |
| Exact Mass | 505.09238 |
| Heavy Atoms | 33 |
| Complexity | 244.0 |
Chemical Identifiers
| CAS Number | 5423-38-1 |
|---|---|
| SMILES | CCCCOC(=O)C1=CC=CC=C1C(=O)[O-].CCCCOC(=O)C1=CC=CC=C1C(=O)[O-].[Cu+2] |
| InChIKey | FQHSBEXCSPGVGY-UHFFFAOYSA-L |
Product Overview
1,2-Benzenedicarboxylic acid, 1-butyl ester, copper(2+) salt (2:1) (CAS 5423-38-1), with molecular formula C24H26CuO8 and molecular weight 505.09 g/mol. IUPAC: copper bis(2-butoxycarbonylbenzoate).
Chemical Property Profile of 1,2-Benzenedicarboxylic acid, 1-butyl ester, copper(2+) salt (2:1)
Property Insights of 1,2-Benzenedicarboxylic acid, 1-butyl ester, copper(2+) salt (2:1)
The XLogP value of 2.01 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1,2-Benzenedicarboxylic acid, 1-butyl ester, copper(2+) salt (2:1). The TPSA of 133.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 1,2-Benzenedicarboxylic acid, 1-butyl ester, copper(2+) salt (2:1). Following Lipinski's Rule of Five, 1,2-Benzenedicarboxylic acid, 1-butyl ester, copper(2+) salt (2:1) has 0 hydrogen bond donor(s) and 8 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 1,2-Benzenedicarboxylic acid, 1-butyl ester, copper(2+) salt (2:1)?
The CAS number of 1,2-Benzenedicarboxylic acid, 1-butyl ester, copper(2+) salt (2:1) is 5423-38-1.
What is the molecular formula of 1,2-Benzenedicarboxylic acid, 1-butyl ester, copper(2+) salt (2:1)?
The molecular formula of 1,2-Benzenedicarboxylic acid, 1-butyl ester, copper(2+) salt (2:1) is C24H26CuO8.
What is the molecular weight of 1,2-Benzenedicarboxylic acid, 1-butyl ester, copper(2+) salt (2:1)?
The molecular weight of 1,2-Benzenedicarboxylic acid, 1-butyl ester, copper(2+) salt (2:1) is 505.09 g/mol.
Where can I buy 1,2-Benzenedicarboxylic acid, 1-butyl ester, copper(2+) salt (2:1)?
You can request a quote for 1,2-Benzenedicarboxylic acid, 1-butyl ester, copper(2+) salt (2:1) 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, 1-butyl ester, copper(2+) salt (2:1)?
Yes, KEHONG BIO provides custom synthesis services for 1,2-Benzenedicarboxylic acid, 1-butyl ester, copper(2+) salt (2:1) and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.