EINECS 267-117-9
TL;DR: EINECS 267-117-9 (CAS 67800-97-9) is a chemical compound with molecular formula C32H24Cl2CrN10NaO8S2 and molecular weight 884.99 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
sodium;bis(4-[(5-chloro-2-oxidophenyl)diazenyl]-3-methyl-1-(3-sulfamoylphenyl)pyrazol-5-olate);chromium(3+)
Also Known As: Bis(4-((5-chloro-2-hydroxyphenyl)azo)-3-methyl-1-(3-sulfamylphenyl)-2-pyrazolin-5-one)chromium(III)complex, sodium, Chromate(1-), bis(3-(4-((5-chloro-2-(hydroxy-kappaO)phenyl)azo-kappaN1)-4,5-dihydro-3-methyl-5-(oxo-kappaO)-1H-pyrazol-1-yl)benzenesulfonamidato(2-))-, sodium, Chromate(1-), bis(3-(4-(2-(5-chloro-2-(hydroxy-kappaO)phenyl)diazenyl-kappaN1)-4,5-dihydro-3-methyl-5-(oxo-kappaO)-1H-pyrazol-1-yl)benzenesulfonamidato(2-))-, sodium (1:1), Chromate(1-), bis[3-[4-[[5-chloro-2-(hydroxy-.kappa.O)phenyl]azo-.kappa.N1]-4,5-dihydro-3-methyl-5-(oxo-.kappa.O)-1H-pyrazol-1-yl]benzenesulfonamidato(2-)]-, sodium, chromium(3+) sodium 4-[(e)-(5-chloro-2-oxidophenyl)diazenyl]-3-methyl-1-(3-sulfamoylphenyl)-1h-pyrazol-5-olate(1:1:2)
| Molecular Formula | C32H24Cl2CrN10NaO8S2 |
|---|---|
| Molecular Weight | 884.99 g/mol |
| LogP | 1.09 |
| Topological Polar Surface Area | 314.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 16 |
| Rotatable Bonds | 8 |
| Exact Mass | 884.99 |
| Heavy Atoms | 56 |
| Complexity | 645.0 |
Chemical Identifiers
| CAS Number | 67800-97-9 |
|---|---|
| SMILES | CC1=NN(C(=C1N=NC2=C(C=CC(=C2)Cl)[O-])[O-])C3=CC(=CC=C3)S(=O)(=O)N.CC1=NN(C(=C1N=NC2=C(C=CC(=C2)Cl)[O-])[O-])C3=CC(=CC=C3)S(=O)(=O)N.[Na+].[Cr+3] |
| InChIKey | YTGBYWAWWCDOAX-UHFFFAOYSA-J |
Product Overview
EINECS 267-117-9 (CAS 67800-97-9), with molecular formula C32H24Cl2CrN10NaO8S2 and molecular weight 884.99 g/mol. IUPAC: sodium;bis(4-[(5-chloro-2-oxidophenyl)diazenyl]-3-methyl-1-(3-sulfamoylphenyl)pyrazol-5-olate);chromium(3+).
Chemical Property Profile of EINECS 267-117-9
Property Insights of EINECS 267-117-9
The XLogP value of 1.09 suggests moderate lipophilicity, balancing water solubility and membrane permeability for EINECS 267-117-9. The TPSA of 314.0 Ų indicates high polarity, suggesting EINECS 267-117-9 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, EINECS 267-117-9 has 2 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 EINECS 267-117-9?
The CAS number of EINECS 267-117-9 is 67800-97-9.
What is the molecular formula of EINECS 267-117-9?
The molecular formula of EINECS 267-117-9 is C32H24Cl2CrN10NaO8S2.
What is the molecular weight of EINECS 267-117-9?
The molecular weight of EINECS 267-117-9 is 884.99 g/mol.
Where can I buy EINECS 267-117-9?
You can request a quote for EINECS 267-117-9 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for EINECS 267-117-9?
Yes, KEHONG BIO provides custom synthesis services for EINECS 267-117-9 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.