Chromate(1-), bis(2-((1-(3-chlorophenyl)-4,5-dihydro-3-methyl-5-(oxo-kappaO)-1H-pyrazol-4-yl)azo-kappaN1)benzoato(2-)-kappaO)-, sodium
TL;DR: Chromate(1-), bis(2-((1-(3-chlorophenyl)-4,5-dihydro-3-methyl-5-(oxo-kappaO)-1H-pyrazol-4-yl)azo-kappaN1)benzoato(2-)-kappaO)-, sodium (CAS 71701-13-8) is a chemical compound with molecular formula C34H22Cl2CrN8NaO6 and molecular weight 783.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
sodium;bis(2-[[1-(4-chlorophenyl)-3-methyl-5-oxidopyrazol-4-yl]diazenyl]benzoate);chromium(3+)
Also Known As: Chromate(1-), bis(2-((1-(3-chlorophenyl)-4,5-dihydro-3-methyl-5-(oxo-kappaO)-1H-pyrazol-4-yl)azo-kappaN1)benzoato(2-)-kappaO)-, sodium, Chromate(1-), bis(2-(2-(1-(3-chlorophenyl)-4,5-dihydro-3-methyl-5-(oxo-kappaO)-1H-pyrazol-4-yl)diazenyl-kappaN1)benzoato(2-)-kappaO)-, sodium (1:1), Chromate(1-), bis[2-[[1-(3-chlorophenyl)-4,5-dihydro-3-methyl-5-(oxo-.kappa.O)-1H-pyrazol-4-yl]azo-.kappa.N1]benzoato(2-)-.kappa.O]-, sodium, Chromate(1-), bis[2-[[1-(3-chlorophenyl)-4,5-dihydro-3-methyl-5-oxo-1H-pyrazol-4-yl]azo]benzoato(2-)]-, sodium, Sodium bis(2-((1-(3-chlorophenyl)-4,5-dihydro-3-methyl-5-oxo-1H-pyrazol-4-yl)azo)benzoato(2-))chromate(1-)
| Molecular Formula | C34H22Cl2CrN8NaO6 |
|---|---|
| Molecular Weight | 783.03 g/mol |
| LogP | 2.37474 |
| Topological Polar Surface Area | 211.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 12 |
| Rotatable Bonds | 6 |
| Exact Mass | 783.0342 |
| Heavy Atoms | 52 |
| Complexity | 493.0 |
Chemical Identifiers
| CAS Number | 71701-13-8 |
|---|---|
| SMILES | CC1=NN(C(=C1N=NC2=CC=CC=C2C(=O)[O-])[O-])C3=CC=C(C=C3)Cl.CC1=NN(C(=C1N=NC2=CC=CC=C2C(=O)[O-])[O-])C3=CC=C(C=C3)Cl.[Na+].[Cr+3] |
| InChIKey | UXGUTRUQKKRXQE-UHFFFAOYSA-J |
Product Overview
Chromate(1-), bis(2-((1-(3-chlorophenyl)-4,5-dihydro-3-methyl-5-(oxo-kappaO)-1H-pyrazol-4-yl)azo-kappaN1)benzoato(2-)-kappaO)-, sodium (CAS 71701-13-8), with molecular formula C34H22Cl2CrN8NaO6 and molecular weight 783.03 g/mol. IUPAC: sodium;bis(2-[[1-(4-chlorophenyl)-3-methyl-5-oxidopyrazol-4-yl]diazenyl]benzoate);chromium(3+).
Chemical Property Profile of Chromate(1-), bis(2-((1-(3-chlorophenyl)-4,5-dihydro-3-methyl-5-(oxo-kappaO)-1H-pyrazol-4-yl)azo-kappaN1)benzoato(2-)-kappaO)-, sodium
Property Insights of Chromate(1-), bis(2-((1-(3-chlorophenyl)-4,5-dihydro-3-methyl-5-(oxo-kappaO)-1H-pyrazol-4-yl)azo-kappaN1)benzoato(2-)-kappaO)-, sodium
The XLogP value of 2.37474 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Chromate(1-), bis(2-((1-(3-chlorophenyl)-4,5-dihydro-3-methyl-5-(oxo-kappaO)-1H-pyrazol-4-yl)azo-kappaN1)benzoato(2-)-kappaO)-, sodium. The TPSA of 211.0 Ų indicates high polarity, suggesting Chromate(1-), bis(2-((1-(3-chlorophenyl)-4,5-dihydro-3-methyl-5-(oxo-kappaO)-1H-pyrazol-4-yl)azo-kappaN1)benzoato(2-)-kappaO)-, sodium may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Chromate(1-), bis(2-((1-(3-chlorophenyl)-4,5-dihydro-3-methyl-5-(oxo-kappaO)-1H-pyrazol-4-yl)azo-kappaN1)benzoato(2-)-kappaO)-, sodium has 0 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 Chromate(1-), bis(2-((1-(3-chlorophenyl)-4,5-dihydro-3-methyl-5-(oxo-kappaO)-1H-pyrazol-4-yl)azo-kappaN1)benzoato(2-)-kappaO)-, sodium?
The CAS number of Chromate(1-), bis(2-((1-(3-chlorophenyl)-4,5-dihydro-3-methyl-5-(oxo-kappaO)-1H-pyrazol-4-yl)azo-kappaN1)benzoato(2-)-kappaO)-, sodium is 71701-13-8.
What is the molecular formula of Chromate(1-), bis(2-((1-(3-chlorophenyl)-4,5-dihydro-3-methyl-5-(oxo-kappaO)-1H-pyrazol-4-yl)azo-kappaN1)benzoato(2-)-kappaO)-, sodium?
The molecular formula of Chromate(1-), bis(2-((1-(3-chlorophenyl)-4,5-dihydro-3-methyl-5-(oxo-kappaO)-1H-pyrazol-4-yl)azo-kappaN1)benzoato(2-)-kappaO)-, sodium is C34H22Cl2CrN8NaO6.
What is the molecular weight of Chromate(1-), bis(2-((1-(3-chlorophenyl)-4,5-dihydro-3-methyl-5-(oxo-kappaO)-1H-pyrazol-4-yl)azo-kappaN1)benzoato(2-)-kappaO)-, sodium?
The molecular weight of Chromate(1-), bis(2-((1-(3-chlorophenyl)-4,5-dihydro-3-methyl-5-(oxo-kappaO)-1H-pyrazol-4-yl)azo-kappaN1)benzoato(2-)-kappaO)-, sodium is 783.03 g/mol.
Where can I buy Chromate(1-), bis(2-((1-(3-chlorophenyl)-4,5-dihydro-3-methyl-5-(oxo-kappaO)-1H-pyrazol-4-yl)azo-kappaN1)benzoato(2-)-kappaO)-, sodium?
You can request a quote for Chromate(1-), bis(2-((1-(3-chlorophenyl)-4,5-dihydro-3-methyl-5-(oxo-kappaO)-1H-pyrazol-4-yl)azo-kappaN1)benzoato(2-)-kappaO)-, sodium directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Chromate(1-), bis(2-((1-(3-chlorophenyl)-4,5-dihydro-3-methyl-5-(oxo-kappaO)-1H-pyrazol-4-yl)azo-kappaN1)benzoato(2-)-kappaO)-, sodium?
Yes, KEHONG BIO provides custom synthesis services for Chromate(1-), bis(2-((1-(3-chlorophenyl)-4,5-dihydro-3-methyl-5-(oxo-kappaO)-1H-pyrazol-4-yl)azo-kappaN1)benzoato(2-)-kappaO)-, sodium and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.