Diarylide Yellow
TL;DR: Diarylide Yellow (CAS 5102-83-0) is a chemical compound with molecular formula C36H34Cl2N6O4 and molecular weight 684.20 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[[2-chloro-4-[3-chloro-4-[[1-(2,4-dimethylanilino)-1,3-dioxobutan-2-yl]diazenyl]phenyl]phenyl]diazenyl]-N-(2,4-dimethylphenyl)-3-oxobutanamide
Also Known As: Pigment yellow 13, Diarylide Yellow, Monolite Yellow GL, Tertropigment PGR, Polymo Yellow GR
| Molecular Formula | C36H34Cl2N6O4 |
|---|---|
| Molecular Weight | 684.20 g/mol |
| LogP | 9.5 |
| Topological Polar Surface Area | 142.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 11 |
| Exact Mass | 684.20184 |
| Heavy Atoms | 48 |
| Complexity | 1110.0 |
Chemical Identifiers
| CAS Number | 5102-83-0 |
|---|---|
| SMILES | CC1=CC(=C(C=C1)NC(=O)C(C(=O)C)N=NC2=C(C=C(C=C2)C3=CC(=C(C=C3)N=NC(C(=O)C)C(=O)NC4=C(C=C(C=C4)C)C)Cl)Cl)C |
| InChIKey | IAFBRPFISOTXSO-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 3 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Diarylide Yellow (CAS 5102-83-0), with molecular formula C36H34Cl2N6O4 and molecular weight 684.20 g/mol. IUPAC: 2-[[2-chloro-4-[3-chloro-4-[[1-(2,4-dimethylanilino)-1,3-dioxobutan-2-yl]diazenyl]phenyl]phenyl]diazenyl]-N-(2,4-dimethylphenyl)-3-oxobutanamide.
Chemical Property Profile of Diarylide Yellow
Property Insights of Diarylide Yellow
The XLogP value of 9.5 indicates that Diarylide Yellow is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 142.0 Ų indicates high polarity, suggesting Diarylide Yellow may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Diarylide Yellow has 2 hydrogen bond donor(s) and 8 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Diarylide Yellow?
The CAS number of Diarylide Yellow is 5102-83-0.
What is the molecular formula of Diarylide Yellow?
The molecular formula of Diarylide Yellow is C36H34Cl2N6O4.
What is the molecular weight of Diarylide Yellow?
The molecular weight of Diarylide Yellow is 684.20 g/mol.
Where can I buy Diarylide Yellow?
You can request a quote for Diarylide Yellow directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Diarylide Yellow?
Yes, KEHONG BIO provides custom synthesis services for Diarylide Yellow and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.