Reactive Orange 86
TL;DR: Reactive Orange 86 (CAS 57359-00-9) is a chemical compound with molecular formula C20H11Cl2N8Na3O10S3 and molecular weight 757.88 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
trisodium;7-[[2-(carbamoylamino)-4-[(4,6-dichloro-1,3,5-triazin-2-yl)amino]phenyl]diazenyl]naphthalene-1,3,6-trisulfonate
Also Known As: Reactive Orange 86, C.I. Reactive orange 86, 1,3,6-Naphthalenetrisulfonic acid, 7-(2-(2-((aminocarbonyl)amino)-4-((4,6-dichloro-1,3,5-triazin-2-yl)amino)phenyl)diazenyl)-, sodium salt (1:3), 1,3,6-Naphthalenetrisulfonic acid, 7-[2-[2-[(aminocarbonyl)amino]-4-[(4,6-dichloro-1,3,5-triazin-2-yl)amino]phenyl]diazenyl]-, sodium salt (1:3), Trisodium 7-[2-[(aminocarbonyl)amino]-4-[(4,6-dichloro-1,3,5-triazin-2-yl)amino]phenyl]azo]naphthalene-1,3,6-trisulphonate
| Molecular Formula | C20H11Cl2N8Na3O10S3 |
|---|---|
| Molecular Weight | 757.88 g/mol |
| LogP | -6.29 |
| Topological Polar Surface Area | 327.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 16 |
| Rotatable Bonds | 5 |
| Exact Mass | 757.88306 |
| Heavy Atoms | 46 |
| Complexity | 1320.0 |
Chemical Identifiers
| CAS Number | 57359-00-9 |
|---|---|
| SMILES | C1=CC(=C(C=C1NC2=NC(=NC(=N2)Cl)Cl)NC(=O)N)N=NC3=CC4=C(C=C(C=C4C=C3S(=O)(=O)[O-])S(=O)(=O)[O-])S(=O)(=O)[O-].[Na+].[Na+].[Na+] |
| InChIKey | CMCWJAWGROJDDZ-UHFFFAOYSA-K |
Product Overview
Reactive Orange 86 (CAS 57359-00-9), with molecular formula C20H11Cl2N8Na3O10S3 and molecular weight 757.88 g/mol. IUPAC: trisodium;7-[[2-(carbamoylamino)-4-[(4,6-dichloro-1,3,5-triazin-2-yl)amino]phenyl]diazenyl]naphthalene-1,3,6-trisulfonate.
Chemical Property Profile of Reactive Orange 86
Property Insights of Reactive Orange 86
The XLogP value of -6.29 indicates that Reactive Orange 86 is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 327.0 Ų indicates high polarity, suggesting Reactive Orange 86 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Reactive Orange 86 has 3 hydrogen bond donor(s) and 16 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Reactive Orange 86?
The CAS number of Reactive Orange 86 is 57359-00-9.
What is the molecular formula of Reactive Orange 86?
The molecular formula of Reactive Orange 86 is C20H11Cl2N8Na3O10S3.
What is the molecular weight of Reactive Orange 86?
The molecular weight of Reactive Orange 86 is 757.88 g/mol.
Where can I buy Reactive Orange 86?
You can request a quote for Reactive Orange 86 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Reactive Orange 86?
Yes, KEHONG BIO provides custom synthesis services for Reactive Orange 86 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.