2-(2-Nitrophenyl)malondialdehyde

Base Information

• Chemical Name: 2-(2-Nitrophenyl)malondialdehyde
• CAS No.: 386715-37-3
• Molecular Formula: C9H7 N O4
• Molecular Weight: 193.16
• Hs Code.: 2913000090
• European Community (EC) Number: 812-961-0
• DSSTox Substance ID: DTXSID60371809
• Wikidata: Q82159264
• Mol file: 386715-37-3.mol

Synonyms:2-(2-Nitrophenyl)malondialdehyde;53868-44-3;2-(2-nitrophenyl)propanedial;2-(2-Nitrophenyl)malonaldehyde;386715-37-3;Benzeneacetaldehyde, a-(hydroxymethylene)-2-nitro-;SCHEMBL2557157;DTXSID60371809;MFCD00216503;AKOS006228042;FT-0676471;J-505685;tert-Butyl1-methyl-4-nitro-1H-pyrrole-2-carboxylate

Chemical Property of 2-(2-Nitrophenyl)malondialdehyde

Chemical Property:

• Boiling Point: 346.3±32.0 °C(Predicted)
• PKA: 2.65±0.10(Predicted)
• PSA: 79.96000
• Density: 1.323±0.06 g/cm3(Predicted)
• LogP: 1.59940
• XLogP3: 1.1
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 3
• Exact Mass: 193.03750770
• Heavy Atom Count: 14
• Complexity: 228

Purity/Quality:

99% ^*data from raw suppliers

2-(2-Nitrophenyl)malonaldehyde ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1=CC=C(C(=C1)C(C=O)C=O)[N+](=O)[O-]