Reactive Orange 14
TL;DR: Reactive Orange 14 (CAS 12225-86-4) is a chemical compound with molecular formula C19H12Cl2N8O9S2 and molecular weight 629.9546 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
4-[[4-[(4,6-dichloro-1,3,5-triazin-2-yl)amino]-2-sulfophenyl]diazenyl]-5-oxo-1-(4-sulfophenyl)-4H-pyrazole-3-carboxylic acid
Also Known As: Reactive Orange 14, Mikacion Yellow 4RS, C.I. Reactive Orange 14, CI Reactive Orange 14, C.I.Reactive Orange 14
Technical Specifications
| Molecular Formula | C19H12Cl2N8O9S2 |
| Molecular Weight | 629.9546 g/mol |
| XLogP | 2.3 |
| Topological Polar Surface Area (TPSA) | 271.0 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 16 |
| Rotatable Bonds | 8 |
| Exact Mass | 629.9546 Da |
| Heavy Atoms | 40 |
| Complexity | 1240.0 |
| SMILES | C1=CC(=CC=C1N2C(=O)C(C(=N2)C(=O)O)N=NC3=C(C=C(C=C3)NC4=NC(=NC(=N4)Cl)Cl)S(=O)(=O)O)S(=O)(=O)O |
| InChIKey | IHRFTCGTRALYFG-UHFFFAOYSA-N |
Chemical Property Profile of Reactive Orange 14
Property Insights of Reactive Orange 14
The XLogP value of 2.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Reactive Orange 14. The TPSA of 271.0 Ų indicates high polarity, suggesting Reactive Orange 14 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Reactive Orange 14 has 4 hydrogen bond donor(s) and 16 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
What is the CAS number of Reactive Orange 14?
The CAS number of Reactive Orange 14 is 12225-86-4.
What is the molecular formula of Reactive Orange 14?
The molecular formula of Reactive Orange 14 is C19H12Cl2N8O9S2.
What is the molecular weight of Reactive Orange 14?
The molecular weight of Reactive Orange 14 is 629.9546 g/mol.
Where can I buy Reactive Orange 14?
You can request a quote for Reactive Orange 14 directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Reactive Orange 14?
Yes, CoreyChem provides custom synthesis services for Reactive Orange 14 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.