苯甲酸铜
TL;DR: 苯甲酸铜 (CAS 533-01-7) is a chemical compound with molecular formula C14H10CuO4 and molecular weight 304.99 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
苯甲酸铜
copper dibenzoate
Also Known As: Cupric benzoate, Copper benzoate, Copper(II) benzoate, Copper dibenzoate, copper;dibenzoate
| Molecular Formula | C14H10CuO4 |
|---|---|
| Molecular Weight | 304.99 g/mol |
| LogP | 0.0977 |
| Topological Polar Surface Area | 80.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 0 |
| Exact Mass | 304.98752 |
| Heavy Atoms | 19 |
| Complexity | 98.0 |
Chemical Identifiers
| CAS Number | 533-01-7 |
|---|---|
| SMILES | C1=CC=C(C=C1)C(=O)[O-].C1=CC=C(C=C1)C(=O)[O-].[Cu+2] |
| InChIKey | YEOCHZFPBYUXMC-UHFFFAOYSA-L |
Patent-Derived Application Labels
Derived from 18 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
苯甲酸铜 (CAS 533-01-7), with molecular formula C14H10CuO4 and molecular weight 304.99 g/mol. IUPAC: copper dibenzoate.
Chemical Property Profile of 苯甲酸铜
Property Insights of 苯甲酸铜
The XLogP value of 0.0977 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 苯甲酸铜. The TPSA of 80.3 Ų falls within the moderate polarity range, balancing permeability and solubility for 苯甲酸铜. Following Lipinski's Rule of Five, 苯甲酸铜 has 0 hydrogen bond donor(s) and 4 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 苯甲酸铜?
The CAS number of 苯甲酸铜 is 533-01-7.
What is the molecular formula of 苯甲酸铜?
The molecular formula of 苯甲酸铜 is C14H10CuO4.
What is the molecular weight of 苯甲酸铜?
The molecular weight of 苯甲酸铜 is 304.99 g/mol.
Where can I buy 苯甲酸铜?
You can request a quote for 苯甲酸铜 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 苯甲酸铜?
Yes, KEHONG BIO provides custom synthesis services for 苯甲酸铜 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.