Bis(DL-mandelato)copper
TL;DR: Bis(DL-mandelato)copper (CAS 102519-25-5) is a chemical compound with molecular formula C16H14CuO6 and molecular weight 365.01 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
copper bis(2-hydroxy-2-phenylacetate)
Also Known As: Copper mandelate, Bis(DL-mandelato)copper, Bis(D,L-mandelato)copper, Copper mandelate (7CI), Copper, bis(D,L-mandelato)-
| Molecular Formula | C16H14CuO6 |
|---|---|
| Molecular Weight | 365.01 g/mol |
| LogP | -1.0627 |
| Topological Polar Surface Area | 121.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 2 |
| Exact Mass | 365.00864 |
| Heavy Atoms | 23 |
| Complexity | 133.0 |
Chemical Identifiers
| CAS Number | 102519-25-5 |
|---|---|
| SMILES | C1=CC=C(C=C1)C(C(=O)[O-])O.C1=CC=C(C=C1)C(C(=O)[O-])O.[Cu+2] |
| InChIKey | YVNZDAXVCOOLPC-UHFFFAOYSA-L |
Patent-Derived Application Labels
Derived from 4 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Bis(DL-mandelato)copper (CAS 102519-25-5), with molecular formula C16H14CuO6 and molecular weight 365.01 g/mol. IUPAC: copper bis(2-hydroxy-2-phenylacetate).
Chemical Property Profile of Bis(DL-mandelato)copper
Property Insights of Bis(DL-mandelato)copper
The XLogP value of -1.0627 indicates that Bis(DL-mandelato)copper is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 121.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Bis(DL-mandelato)copper. Following Lipinski's Rule of Five, Bis(DL-mandelato)copper has 2 hydrogen bond donor(s) and 6 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 Bis(DL-mandelato)copper?
The CAS number of Bis(DL-mandelato)copper is 102519-25-5.
What is the molecular formula of Bis(DL-mandelato)copper?
The molecular formula of Bis(DL-mandelato)copper is C16H14CuO6.
What is the molecular weight of Bis(DL-mandelato)copper?
The molecular weight of Bis(DL-mandelato)copper is 365.01 g/mol.
Where can I buy Bis(DL-mandelato)copper?
You can request a quote for Bis(DL-mandelato)copper directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Bis(DL-mandelato)copper?
Yes, KEHONG BIO provides custom synthesis services for Bis(DL-mandelato)copper and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.