RefChem:88592
TL;DR: RefChem:88592 (CAS 18886-16-3) is a chemical compound with molecular formula C19H10Cl2N6Na2O7S2 and molecular weight 613.92 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
disodium;7-[(4,6-dichloro-1,3,5-triazin-2-yl)amino]-4-hydroxy-3-[(2-sulfonatophenyl)diazenyl]naphthalene-2-sulfonate
Also Known As: C.I. Reactive Orange 1, disodium salt, Disodium 7-[(4,6-dichloro-1,3,5-triazin-2-yl)amino]-4-hydroxy-3-[(2-sulphonatophenyl)azo]naphthalene-2-sulphonate, 2-Naphthalenesulfonic acid, 7-((4,6-dichloro-1,3,5-triazin-2-yl)amino)-4-hydroxy-3-((2-sulfophenyl)azo)-, disodium salt, 2-Naphthalenesulfonic acid, 7-((4,6-dichloro-1,3,5-triazin-2-yl)amino)-4-hydroxy-3-(2-(2-sulfophenyl)diazenyl)-, sodium salt (1:2), Disodium;7-[(4,6-dichloro-1,3,5-triazin-2-yl)amino]-4-hydroxy-3-[(2-sulfonatophenyl)diazenyl]naphthalene-2-sulfonate
| Molecular Formula | C19H10Cl2N6Na2O7S2 |
|---|---|
| Molecular Weight | 613.92 g/mol |
| LogP | -1.9876 |
| Topological Polar Surface Area | 227.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 13 |
| Rotatable Bonds | 4 |
| Exact Mass | 613.9225 |
| Heavy Atoms | 38 |
| Complexity | 974.0 |
Chemical Identifiers
| CAS Number | 18886-16-3 |
|---|---|
| SMILES | C1=CC=C(C(=C1)N=NC2=C(C=C3C=C(C=CC3=C2O)NC4=NC(=NC(=N4)Cl)Cl)S(=O)(=O)[O-])S(=O)(=O)[O-].[Na+].[Na+] |
| InChIKey | OWJBWTPIJLQHBO-UHFFFAOYSA-L |
Product Overview
RefChem:88592 (CAS 18886-16-3), with molecular formula C19H10Cl2N6Na2O7S2 and molecular weight 613.92 g/mol. IUPAC: disodium;7-[(4,6-dichloro-1,3,5-triazin-2-yl)amino]-4-hydroxy-3-[(2-sulfonatophenyl)diazenyl]naphthalene-2-sulfonate.
Chemical Property Profile of RefChem:88592
Property Insights of RefChem:88592
The XLogP value of -1.9876 indicates that RefChem:88592 is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 227.0 Ų indicates high polarity, suggesting RefChem:88592 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, RefChem:88592 has 2 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 RefChem:88592?
The CAS number of RefChem:88592 is 18886-16-3.
What is the molecular formula of RefChem:88592?
The molecular formula of RefChem:88592 is C19H10Cl2N6Na2O7S2.
What is the molecular weight of RefChem:88592?
The molecular weight of RefChem:88592 is 613.92 g/mol.
Where can I buy RefChem:88592?
You can request a quote for RefChem:88592 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:88592?
Yes, KEHONG BIO provides custom synthesis services for RefChem:88592 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.