Reactive Blue 69
TL;DR: Reactive Blue 69 (CAS 90599-28-3) is a chemical compound with molecular formula C23H14BrN3Na2O9S2 and molecular weight 664.92 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
disodium;1-amino-4-[4-(2-bromoprop-2-enoylamino)-2-sulfonatoanilino]-9,10-dioxoanthracene-2-sulfonate
Also Known As: Reactive Blue 69, CI Reactive Blue 69, C.I.Reactive Blue 69, C.I. Reactive Blue 69, 2-Anthracenesulfonic acid, 1-amino-4-((4-((2-bromo-1-oxo-2-propen-1-yl)amino)-2-sulfophenyl)amino)-9,10-dihydro-9,10-dioxo-, sodium salt (1:2)
| Molecular Formula | C23H14BrN3Na2O9S2 |
|---|---|
| Molecular Weight | 664.92 g/mol |
| LogP | -3.5489 |
| Topological Polar Surface Area | 232.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 11 |
| Rotatable Bonds | 4 |
| Exact Mass | 664.91504 |
| Heavy Atoms | 40 |
| Complexity | 1190.0 |
Chemical Identifiers
| CAS Number | 90599-28-3 |
|---|---|
| SMILES | C=C(C(=O)NC1=CC(=C(C=C1)NC2=CC(=C(C3=C2C(=O)C4=CC=CC=C4C3=O)N)S(=O)(=O)[O-])S(=O)(=O)[O-])Br.[Na+].[Na+] |
| InChIKey | BCENAVMKNRCXMQ-UHFFFAOYSA-L |
Product Overview
Reactive Blue 69 (CAS 90599-28-3), with molecular formula C23H14BrN3Na2O9S2 and molecular weight 664.92 g/mol. IUPAC: disodium;1-amino-4-[4-(2-bromoprop-2-enoylamino)-2-sulfonatoanilino]-9,10-dioxoanthracene-2-sulfonate.
Chemical Property Profile of Reactive Blue 69
Property Insights of Reactive Blue 69
The XLogP value of -3.5489 indicates that Reactive Blue 69 is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 232.0 Ų indicates high polarity, suggesting Reactive Blue 69 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Reactive Blue 69 has 3 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 Reactive Blue 69?
The CAS number of Reactive Blue 69 is 90599-28-3.
What is the molecular formula of Reactive Blue 69?
The molecular formula of Reactive Blue 69 is C23H14BrN3Na2O9S2.
What is the molecular weight of Reactive Blue 69?
The molecular weight of Reactive Blue 69 is 664.92 g/mol.
Where can I buy Reactive Blue 69?
You can request a quote for Reactive Blue 69 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Reactive Blue 69?
Yes, KEHONG BIO provides custom synthesis services for Reactive Blue 69 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.