3-{(2E)-2-[3-methyl-1-(4-nitrophenyl)-5-oxo-1,5-dihydro-4H-pyrazol-4-ylidene]hydrazinyl}benzoic acid

Base Information

• Chemical Name: 3-{(2E)-2-[3-methyl-1-(4-nitrophenyl)-5-oxo-1,5-dihydro-4H-pyrazol-4-ylidene]hydrazinyl}benzoic acid
• CAS No.: 5722-28-1
• Molecular Formula: C17H13N5O5
• Molecular Weight: 367.3156
• DSSTox Substance ID: DTXSID50416617
• Mol file: 5722-28-1.mol

Synonyms:STK040230;3-{(2E)-2-[3-methyl-1-(4-nitrophenyl)-5-oxo-1,5-dihydro-4H-pyrazol-4-ylidene]hydrazinyl}benzoic acid;5722-28-1;DTXSID50416617;AKOS000584355;AKOS005383211

Chemical Property of 3-{(2E)-2-[3-methyl-1-(4-nitrophenyl)-5-oxo-1,5-dihydro-4H-pyrazol-4-ylidene]hydrazinyl}benzoic acid

Chemical Property:

• Vapor Pressure: 7.08E-15mmHg at 25°C
• Boiling Point: 592.3°Cat760mmHg
• Flash Point: 312°C
• Density: 1.51g/cm³
• XLogP3: 3.2
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 8
• Rotatable Bond Count: 4
• Exact Mass: 367.09166853
• Heavy Atom Count: 27
• Complexity: 678

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC1=C(C(=O)N(N1)C2=CC=C(C=C2)[N+](=O)[O-])N=NC3=CC=CC(=C3)C(=O)O