RefChem:578124
TL;DR: RefChem:578124 (CAS 71243-97-5) is a chemical compound with molecular formula C36H20ClCoN5NaO9S and molecular weight 814.99 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
sodium;1-[(5-chloro-2-oxidophenyl)diazenyl]naphthalen-2-olate;cobalt(3+);hydron;7-nitro-3-oxido-4-[(2-oxidonaphthalen-1-yl)diazenyl]naphthalene-1-sulfonate
Also Known As: Cobaltate(2-), (1-((5-chloro-2-(hydroxy-kappaO)phenyl)azo-kappaN1)-2-naphthalenolato(2-)-kappaO)(3-(hydroxy-kappaO)-4-((2-(hydroxy-kappaO)-1-naphthalenyl)azo-kappaN1)-7-nitro-1-naphthalenesulfonato(3-))-, sodium hydrogen, 1-(2-Hydroxy-5-chlorophenylazo)-2-hydroxynaphthalene, 1-2-hydroxy-6-nitro-4-sulfonaphthyl-1-azo)-2-hydroxynaphthalene sodium salt, cobalt complex, Cobaltate(2-), (1-(2-(5-chloro-2-(hydroxy-kappaO)phenyl)diazenyl-kappaN1)-2-naphthalenolato(2-)-kappaO)(3-(hydroxy-kappaO)-4-(2-(2-(hydroxy-kappaO)-1-naphthalenyl)diazenyl-kappaN1)-7-nitro-1-naphthalenesulfonato(3-))-, sodium hydrogen (1:1:1), Cobaltate(2-), [1-[(5-chloro-2-hydroxyphenyl)azo]-2-naphthalenolato(2-)][3-hydroxy-4-[(2-hydroxy-1-naphthalenyl)azo]-7-nitro-1-naphthalenesulfonato(3-)]-, sodium hydrogen, Cobaltate(2-), (1-((5-chloro-2-hydroxyphenyl)azo)-2-naphthalenolato(2-))(3-hydroxy-4-((2-hydroxy-1-naphthalenyl)azo)-7-nitro-1-naphthalenesulfonato(3-))-, sodium hydrogen
| Molecular Formula | C36H20ClCoN5NaO9S |
|---|---|
| Molecular Weight | 814.99 g/mol |
| LogP | 4.5377 |
| Topological Polar Surface Area | 253.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 13 |
| Rotatable Bonds | 4 |
| Exact Mass | 814.99 |
| Heavy Atoms | 54 |
| Complexity | 1160.0 |
Chemical Identifiers
| CAS Number | 71243-97-5 |
|---|---|
| SMILES | [H+].C1=CC=C2C(=C1)C=CC(=C2N=NC3=C(C=CC(=C3)Cl)[O-])[O-].C1=CC=C2C(=C1)C=CC(=C2N=NC3=C4C=CC(=CC4=C(C=C3[O-])S(=O)(=O)[O-])[N+](=O)[O-])[O-].[Na+].[Co+3] |
| InChIKey | QCYLPQJJLXPZJH-UHFFFAOYSA-J |
Product Overview
RefChem:578124 (CAS 71243-97-5), with molecular formula C36H20ClCoN5NaO9S and molecular weight 814.99 g/mol. IUPAC: sodium;1-[(5-chloro-2-oxidophenyl)diazenyl]naphthalen-2-olate;cobalt(3+);hydron;7-nitro-3-oxido-4-[(2-oxidonaphthalen-1-yl)diazenyl]naphthalene-1-sulfonate.
Chemical Property Profile of RefChem:578124
Property Insights of RefChem:578124
The XLogP value of 4.5377 indicates that RefChem:578124 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 253.0 Ų indicates high polarity, suggesting RefChem:578124 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, RefChem:578124 has 1 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:578124?
The CAS number of RefChem:578124 is 71243-97-5.
What is the molecular formula of RefChem:578124?
The molecular formula of RefChem:578124 is C36H20ClCoN5NaO9S.
What is the molecular weight of RefChem:578124?
The molecular weight of RefChem:578124 is 814.99 g/mol.
Where can I buy RefChem:578124?
You can request a quote for RefChem:578124 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:578124?
Yes, KEHONG BIO provides custom synthesis services for RefChem:578124 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.