DISPERSE BLUE 79
TL;DR: DISPERSE BLUE 79 (CAS 12239-34-8) is a chemical compound with molecular formula C24H27BrN6O10 and molecular weight 638.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[5-acetamido-N-(2-acetyloxyethyl)-4-[(2-bromo-3,5-dinitrophenyl)diazenyl]-2-ethoxyanilino]ethyl acetate
Also Known As: DISPERSE BLUE 79, 2-[5-acetamido-N-(2-acetyloxyethyl)-4-[(2-bromo-3,5-dinitrophenyl)diazenyl]-2-ethoxyanilino]ethyl acetate
| Molecular Formula | C24H27BrN6O10 |
|---|---|
| Molecular Weight | 638.10 g/mol |
| LogP | 3.5 |
| Topological Polar Surface Area | 211.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 13 |
| Rotatable Bonds | 14 |
| Exact Mass | 638.0972 |
| Heavy Atoms | 41 |
| Complexity | 940.0 |
Chemical Identifiers
| CAS Number | 12239-34-8 |
|---|---|
| SMILES | CCOC1=C(C=C(C(=C1)N=NC2=C(C(=CC(=C2)[N+](=O)[O-])[N+](=O)[O-])Br)NC(=O)C)N(CCOC(=O)C)CCOC(=O)C |
| InChIKey | KOAZOWWCVCWYMN-UHFFFAOYSA-N |
Product Overview
DISPERSE BLUE 79 (CAS 12239-34-8), with molecular formula C24H27BrN6O10 and molecular weight 638.10 g/mol. IUPAC: 2-[5-acetamido-N-(2-acetyloxyethyl)-4-[(2-bromo-3,5-dinitrophenyl)diazenyl]-2-ethoxyanilino]ethyl acetate.
Chemical Property Profile of DISPERSE BLUE 79
Property Insights of DISPERSE BLUE 79
The XLogP value of 3.5 indicates that DISPERSE BLUE 79 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 211.0 Ų indicates high polarity, suggesting DISPERSE BLUE 79 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, DISPERSE BLUE 79 has 1 hydrogen bond donor(s) and 13 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of DISPERSE BLUE 79?
The CAS number of DISPERSE BLUE 79 is 12239-34-8.
What is the molecular formula of DISPERSE BLUE 79?
The molecular formula of DISPERSE BLUE 79 is C24H27BrN6O10.
What is the molecular weight of DISPERSE BLUE 79?
The molecular weight of DISPERSE BLUE 79 is 638.10 g/mol.
Where can I buy DISPERSE BLUE 79?
You can request a quote for DISPERSE BLUE 79 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for DISPERSE BLUE 79?
Yes, KEHONG BIO provides custom synthesis services for DISPERSE BLUE 79 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.