Alkali Blue 6B
TL;DR: Alkali Blue 6B (CAS 58569-23-6) is a chemical compound with molecular formula C32H28N3NaO4S and molecular weight 573.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
sodium 4-[4-[(4-amino-3-methylphenyl)-(4-anilinophenyl)-hydroxymethyl]anilino]benzenesulfonate
Also Known As: Alkali Blue 6B, Alkali blue, Alkali Blue G, Alkali blue solution, EINECS 232-331-3
| Molecular Formula | C32H28N3NaO4S |
|---|---|
| Molecular Weight | 573.17 g/mol |
| LogP | 3.25672 |
| Topological Polar Surface Area | 127.51 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 8 |
| Exact Mass | 573.1698 |
| Heavy Atoms | 41 |
| Complexity | 1729.7823 |
Chemical Identifiers
| CAS Number | 58569-23-6 |
|---|---|
| SMILES | CC1=C(C=CC(=C1)C(C2=CC=C(C=C2)NC3=CC=CC=C3)(C4=CC=C(C=C4)NC5=CC=C(C=C5)S(=O)(=O)[O-])O)N.[Na+] |
Product Overview
Alkali Blue 6B (CAS 58569-23-6), with molecular formula C32H28N3NaO4S and molecular weight 573.17 g/mol. IUPAC: sodium 4-[4-[(4-amino-3-methylphenyl)-(4-anilinophenyl)-hydroxymethyl]anilino]benzenesulfonate.
Chemical Property Profile of Alkali Blue 6B
Property Insights of Alkali Blue 6B
The XLogP value of 3.25672 indicates that Alkali Blue 6B is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 127.51 Ų falls within the moderate polarity range, balancing permeability and solubility for Alkali Blue 6B. Following Lipinski's Rule of Five, Alkali Blue 6B has 4 hydrogen bond donor(s) and 7 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Alkali Blue 6B?
The CAS number of Alkali Blue 6B is 58569-23-6.
What is the molecular formula of Alkali Blue 6B?
The molecular formula of Alkali Blue 6B is C32H28N3NaO4S.
What is the molecular weight of Alkali Blue 6B?
The molecular weight of Alkali Blue 6B is 573.17 g/mol.
Where can I buy Alkali Blue 6B?
You can request a quote for Alkali Blue 6B directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Alkali Blue 6B?
Yes, KEHONG BIO provides custom synthesis services for Alkali Blue 6B and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.