N-[5-(3-methylphenyl)-1H-pyrazol-3-yl]-2-nitrobenzamide

Base Information

• Chemical Name: N-[5-(3-methylphenyl)-1H-pyrazol-3-yl]-2-nitrobenzamide
• CAS No.: 6139-37-3
• Molecular Formula: C17H14N4O3
• Molecular Weight: 322.3181
• DSSTox Substance ID: DTXSID10395075
• Wikidata: Q82194877
• Mol file: 6139-37-3.mol

Synonyms:6139-37-3;N-[5-(3-methylphenyl)-1H-pyrazol-3-yl]-2-nitrobenzamide;ZINC00442950;CBMicro_008709;Cambridge id 6139373;Oprea1_579138;DTXSID10395075;SMSF0014950;BIM-0008865.P001;SR-01000228892;SR-01000228892-1

Chemical Property of N-[5-(3-methylphenyl)-1H-pyrazol-3-yl]-2-nitrobenzamide

Chemical Property:

• Vapor Pressure: 2.17E-10mmHg at 25°C
• Boiling Point: 506.7°Cat760mmHg
• Flash Point: 260.2°C
• Density: 1.381g/cm³
• XLogP3: 3.2
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 3
• Exact Mass: 322.10659032
• Heavy Atom Count: 24
• Complexity: 467

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC1=CC(=CC=C1)C2=CC(=NN2)NC(=O)C3=CC=CC=C3[N+](=O)[O-]