Disperse Blue 1
TL;DR: Disperse Blue 1 (CAS 2475-45-8) is a chemical compound with molecular formula C14H12N4O2 and molecular weight 268.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1,4,5,8-tetraaminoanthracene-9,10-dione
Also Known As: DISPERSE BLUE 1, Acetate Blue G, Celliton Blue G, Perliton Blue B, Fenacet Blue G
| Molecular Formula | C14H12N4O2 |
|---|---|
| Molecular Weight | 268.10 g/mol |
| LogP | 1.2 |
| Topological Polar Surface Area | 138.0 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 0 |
| Exact Mass | 268.09604 |
| Heavy Atoms | 20 |
| Complexity | 365.0 |
| Melting Point | 332.2 °C |
| Solubility | less than 0.1 mg/mL at 64 °F (NTP, 1992) |
| Vapor Pressure | 0.00000002 [mmHg] |
Chemical Identifiers
| CAS Number | 2475-45-8 |
|---|---|
| SMILES | C1=CC(=C2C(=C1N)C(=O)C3=C(C=CC(=C3C2=O)N)N)N |
| InChIKey | JSFUMBWFPQSADC-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 20 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Disperse Blue 1 (CAS 2475-45-8), with molecular formula C14H12N4O2 and molecular weight 268.10 g/mol. IUPAC: 1,4,5,8-tetraaminoanthracene-9,10-dione.
Chemical Property Profile of Disperse Blue 1
Property Insights of Disperse Blue 1
The XLogP value of 1.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Disperse Blue 1. The TPSA of 138.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Disperse Blue 1. Following Lipinski's Rule of Five, Disperse Blue 1 has 4 hydrogen bond donor(s) and 6 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 1?
The CAS number of Disperse Blue 1 is 2475-45-8.
What is the molecular formula of Disperse Blue 1?
The molecular formula of Disperse Blue 1 is C14H12N4O2.
What is the molecular weight of Disperse Blue 1?
The molecular weight of Disperse Blue 1 is 268.10 g/mol.
Where can I buy Disperse Blue 1?
You can request a quote for Disperse Blue 1 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Disperse Blue 1?
Yes, KEHONG BIO provides custom synthesis services for Disperse Blue 1 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.