EINECS 274-884-3
TL;DR: EINECS 274-884-3 (CAS 70776-97-5) is a chemical compound with molecular formula C32H25Cl2CrN10O8S2 and molecular weight 863.01 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
bis(4-[(5-chloro-2-oxidophenyl)diazenyl]-3-methyl-1-(4-sulfamoylphenyl)pyrazol-5-olate);chromium(3+);hydron
Also Known As: 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-))-, hydrogen, 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-))-, hydrogen (1:1), 4-[(5-chloro-2-oxidophenyl)diazenyl]-5-methyl-2-(4-sulfamoylphenyl)pyrazol-3-olate; chromium(3+); hydron, Chromate(1-), bis[3-[4-[(5-chloro-2-hydroxyphenyl)azo]-4,5-dihydro-3-methyl-5-oxo-1H-pyrazol-1-yl]benzenesulfonamidato(2-)]-, hydrogen, 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-)]-, hydrogen
| Molecular Formula | C32H25Cl2CrN10O8S2 |
|---|---|
| Molecular Weight | 863.01 g/mol |
| LogP | 4.19824 |
| Topological Polar Surface Area | 314.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 16 |
| Rotatable Bonds | 8 |
| Exact Mass | 863.00806 |
| Heavy Atoms | 55 |
| Complexity | 637.0 |
Chemical Identifiers
| CAS Number | 70776-97-5 |
|---|---|
| SMILES | [H+].CC1=NN(C(=C1N=NC2=C(C=CC(=C2)Cl)[O-])[O-])C3=CC=C(C=C3)S(=O)(=O)N.CC1=NN(C(=C1N=NC2=C(C=CC(=C2)Cl)[O-])[O-])C3=CC=C(C=C3)S(=O)(=O)N.[Cr+3] |
| InChIKey | YUNNVEQVTQRFJI-UHFFFAOYSA-K |
Product Overview
EINECS 274-884-3 (CAS 70776-97-5), with molecular formula C32H25Cl2CrN10O8S2 and molecular weight 863.01 g/mol. IUPAC: bis(4-[(5-chloro-2-oxidophenyl)diazenyl]-3-methyl-1-(4-sulfamoylphenyl)pyrazol-5-olate);chromium(3+);hydron.
Chemical Property Profile of EINECS 274-884-3
Property Insights of EINECS 274-884-3
The XLogP value of 4.19824 indicates that EINECS 274-884-3 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 314.0 Ų indicates high polarity, suggesting EINECS 274-884-3 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, EINECS 274-884-3 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 EINECS 274-884-3?
The CAS number of EINECS 274-884-3 is 70776-97-5.
What is the molecular formula of EINECS 274-884-3?
The molecular formula of EINECS 274-884-3 is C32H25Cl2CrN10O8S2.
What is the molecular weight of EINECS 274-884-3?
The molecular weight of EINECS 274-884-3 is 863.01 g/mol.
Where can I buy EINECS 274-884-3?
You can request a quote for EINECS 274-884-3 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for EINECS 274-884-3?
Yes, KEHONG BIO provides custom synthesis services for EINECS 274-884-3 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.