Benzophenone 9
TL;DR: Benzophenone 9 (CAS 3121-60-6) is a chemical compound with molecular formula C15H12Na2O11S2 and molecular weight 477.96 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
disodium;4-hydroxy-5-(2-hydroxy-4-methoxy-5-sulfonatobenzoyl)-2-methoxybenzenesulfonate
Also Known As: Benzophenone 9, Uvinuc ds 49, benzophenone9, Uvinul 3048, Uvinul DS 49
| Molecular Formula | C15H12Na2O11S2 |
|---|---|
| Molecular Weight | 477.96 g/mol |
| LogP | -5.8378 |
| Topological Polar Surface Area | 207.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 11 |
| Rotatable Bonds | 4 |
| Exact Mass | 477.96164 |
| Heavy Atoms | 30 |
| Complexity | 676.0 |
Chemical Identifiers
| CAS Number | 3121-60-6 |
|---|---|
| SMILES | COC1=C(C=C(C(=C1)O)C(=O)C2=CC(=C(C=C2O)OC)S(=O)(=O)[O-])S(=O)(=O)[O-].[Na+].[Na+] |
| InChIKey | QDCHWIWENYCPIL-UHFFFAOYSA-L |
Patent-Derived Application Labels
Derived from 12 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Benzophenone 9 (CAS 3121-60-6), with molecular formula C15H12Na2O11S2 and molecular weight 477.96 g/mol. IUPAC: disodium;4-hydroxy-5-(2-hydroxy-4-methoxy-5-sulfonatobenzoyl)-2-methoxybenzenesulfonate.
Chemical Property Profile of Benzophenone 9
Property Insights of Benzophenone 9
The XLogP value of -5.8378 indicates that Benzophenone 9 is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 207.0 Ų indicates high polarity, suggesting Benzophenone 9 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Benzophenone 9 has 2 hydrogen bond donor(s) and 11 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Benzophenone 9?
The CAS number of Benzophenone 9 is 3121-60-6.
What is the molecular formula of Benzophenone 9?
The molecular formula of Benzophenone 9 is C15H12Na2O11S2.
What is the molecular weight of Benzophenone 9?
The molecular weight of Benzophenone 9 is 477.96 g/mol.
Where can I buy Benzophenone 9?
You can request a quote for Benzophenone 9 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Benzophenone 9?
Yes, KEHONG BIO provides custom synthesis services for Benzophenone 9 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.