RefChem:576422
TL;DR: RefChem:576422 (CAS 52455-30-8) is a chemical compound with molecular formula C20H16CrN3NaO10S and molecular weight 564.99 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
sodium;chromium(2+);7-nitro-3-oxido-4-[(2-oxidonaphthalen-1-yl)diazenyl]naphthalene-1-sulfonate;trihydrate
Also Known As: Chromate(1-), triaqua(3-(hydroxy-kappaO)-4-((2-(hydroxy-kappaO)-1-naphthalenyl)azo-kappaN1)-7-nitro-1-naphthalenesulfonato(3-))-, sodium, Chromate(1-), triaqua(3-(hydroxy-kappaO)-4-(2-(2-(hydroxy-kappaO)-1-naphthalenyl)diazenyl-kappaN1)-7-nitro-1-naphthalenesulfonato(3-))-, sodium (1:1), Sodium triaqua(3-hydroxy-4-((2-hydroxy-1-naphthyl)azo)-7-nitronaphthalene-1-sulphonato(3-))chromate(1-), Chromate(1-), triaqua(3-hydroxy-4-((2-hydroxy-1-naphthalenyl)azo)-7-nitro-1-naphthalenesulfonato(3-))-, sodium, Chromate(1-), triaqua[3-(hydroxy-.kappa.O)-4-[[2-(hydroxy-.kappa.O)-1-naphthalenyl]azo-.kappa.N1]-7-nitro-1-naphthalenesulfonato(3-)]-, sodium
| Molecular Formula | C20H16CrN3NaO10S |
|---|---|
| Molecular Weight | 564.99 g/mol |
| LogP | -2.1 |
| Topological Polar Surface Area | 185.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 12 |
| Rotatable Bonds | 2 |
| Exact Mass | 564.9859 |
| Heavy Atoms | 36 |
| Complexity | 782.0 |
Chemical Identifiers
| CAS Number | 52455-30-8 |
|---|---|
| SMILES | C1=CC=C2C(=C1)C=CC(=C2N=NC3=C4C=CC(=CC4=C(C=C3[O-])S(=O)(=O)[O-])[N+](=O)[O-])[O-].O.O.O.[Na+].[Cr+2] |
| InChIKey | AMNUWPJNRKWMFK-UHFFFAOYSA-K |
Product Overview
RefChem:576422 (CAS 52455-30-8), with molecular formula C20H16CrN3NaO10S and molecular weight 564.99 g/mol. IUPAC: sodium;chromium(2+);7-nitro-3-oxido-4-[(2-oxidonaphthalen-1-yl)diazenyl]naphthalene-1-sulfonate;trihydrate.
Chemical Property Profile of RefChem:576422
Property Insights of RefChem:576422
The XLogP value of -2.1 indicates that RefChem:576422 is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 185.0 Ų indicates high polarity, suggesting RefChem:576422 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, RefChem:576422 has 3 hydrogen bond donor(s) and 12 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of RefChem:576422?
The CAS number of RefChem:576422 is 52455-30-8.
What is the molecular formula of RefChem:576422?
The molecular formula of RefChem:576422 is C20H16CrN3NaO10S.
What is the molecular weight of RefChem:576422?
The molecular weight of RefChem:576422 is 564.99 g/mol.
Where can I buy RefChem:576422?
You can request a quote for RefChem:576422 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:576422?
Yes, KEHONG BIO provides custom synthesis services for RefChem:576422 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.