Rose Bengal Sodium
TL;DR: Rose Bengal Sodium (CAS 632-69-9) is a chemical compound with molecular formula C20H2Cl4I4Na2O5 and molecular weight 1015.46 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
disodium;2,3,4,5-tetrachloro-6-(2,4,5,7-tetraiodo-3-oxido-6-oxoxanthen-9-yl)benzoate
Also Known As: ROSE BENGAL, Rose bengal sodium, Acid Red 94, Rose bengal extra, Rose Bengal sodium salt
| Molecular Formula | C20H2Cl4I4Na2O5 |
|---|---|
| Molecular Weight | 1015.46 g/mol |
| LogP | 1.04 |
| Topological Polar Surface Area | 89.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 1 |
| Exact Mass | 1017.4601 |
| Heavy Atoms | 35 |
| Complexity | 936.0 |
Chemical Identifiers
| CAS Number | 632-69-9 |
|---|---|
| SMILES | C1=C2C(=C3C=C(C(=O)C(=C3OC2=C(C(=C1I)[O-])I)I)I)C4=C(C(=C(C(=C4Cl)Cl)Cl)Cl)C(=O)[O-].[Na+].[Na+] |
| InChIKey | UWBXIFCTIZXXLS-UHFFFAOYSA-L |
Product Overview
Rose Bengal Sodium (CAS 632-69-9), with molecular formula C20H2Cl4I4Na2O5 and molecular weight 1015.46 g/mol. IUPAC: disodium;2,3,4,5-tetrachloro-6-(2,4,5,7-tetraiodo-3-oxido-6-oxoxanthen-9-yl)benzoate.
Chemical Property Profile of Rose Bengal Sodium
Property Insights of Rose Bengal Sodium
The XLogP value of 1.04 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Rose Bengal Sodium. The TPSA of 89.5 Ų falls within the moderate polarity range, balancing permeability and solubility for Rose Bengal Sodium. Following Lipinski's Rule of Five, Rose Bengal Sodium has 0 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Rose Bengal Sodium?
The CAS number of Rose Bengal Sodium is 632-69-9.
What is the molecular formula of Rose Bengal Sodium?
The molecular formula of Rose Bengal Sodium is C20H2Cl4I4Na2O5.
What is the molecular weight of Rose Bengal Sodium?
The molecular weight of Rose Bengal Sodium is 1015.46 g/mol.
Where can I buy Rose Bengal Sodium?
You can request a quote for Rose Bengal Sodium directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Rose Bengal Sodium?
Yes, KEHONG BIO provides custom synthesis services for Rose Bengal Sodium and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.