Disperse Blue 77
TL;DR: Disperse Blue 77 (CAS 20241-76-3) is a chemical compound with molecular formula C20H12N2O6 and molecular weight 376.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-anilino-4,5-dihydroxy-8-nitroanthracene-9,10-dione
Also Known As: Disperse Blue 77, 4-Anilino-5-nitrochrysazin, C.I.Disperse Blue 77, CI Disperse Blue 54, C.I. Disperse Blue 77
| Molecular Formula | C20H12N2O6 |
|---|---|
| Molecular Weight | 376.07 g/mol |
| LogP | 3.525 |
| Topological Polar Surface Area | 129.77 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 3 |
| Exact Mass | 376.06955 |
| Heavy Atoms | 28 |
| Complexity | 1171.0586 |
Chemical Identifiers
| CAS Number | 20241-76-3 |
|---|---|
| SMILES | C1=CC=C(C=C1)NC2=C3C(=C(C=C2)O)C(=O)C4=C(C=CC(=C4C3=O)[N+](=O)[O-])O |
Product Overview
Disperse Blue 77 (CAS 20241-76-3), with molecular formula C20H12N2O6 and molecular weight 376.07 g/mol. IUPAC: 1-anilino-4,5-dihydroxy-8-nitroanthracene-9,10-dione.
Chemical Property Profile of Disperse Blue 77
Property Insights of Disperse Blue 77
The XLogP value of 3.525 indicates that Disperse Blue 77 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 129.77 Ų falls within the moderate polarity range, balancing permeability and solubility for Disperse Blue 77. Following Lipinski's Rule of Five, Disperse Blue 77 has 3 hydrogen bond donor(s) and 7 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 Disperse Blue 77?
The CAS number of Disperse Blue 77 is 20241-76-3.
What is the molecular formula of Disperse Blue 77?
The molecular formula of Disperse Blue 77 is C20H12N2O6.
What is the molecular weight of Disperse Blue 77?
The molecular weight of Disperse Blue 77 is 376.07 g/mol.
Where can I buy Disperse Blue 77?
You can request a quote for Disperse Blue 77 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Disperse Blue 77?
Yes, KEHONG BIO provides custom synthesis services for Disperse Blue 77 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.