Methyl 4-(2-bromo-4-nitroanilino)-4-oxobutanoate

Base Information

• Chemical Name: Methyl 4-(2-bromo-4-nitroanilino)-4-oxobutanoate
• CAS No.: 5105-16-8
• Molecular Formula: C11H11BrN2O5
• Molecular Weight: 331.1194
• DSSTox Substance ID: DTXSID60385143
• Wikidata: Q82177739
• Mol file: 5105-16-8.mol

Synonyms:5105-16-8;methyl 4-(2-bromo-4-nitroanilino)-4-oxobutanoate;methyl 4-[(2-bromo-4-nitrophenyl)amino]-4-oxobutanoate;DTXSID60385143;STK026824;AKOS000486155;AB00073707-01;SR-01000195283;SR-01000195283-1

Chemical Property of Methyl 4-(2-bromo-4-nitroanilino)-4-oxobutanoate

Chemical Property:

• Vapor Pressure: 3.23E-10mmHg at 25°C
• Boiling Point: 502.3°C at 760 mmHg
• Flash Point: 257.6°C
• Density: 1.626g/cm³
• XLogP3: 1.4
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 5
• Rotatable Bond Count: 5
• Exact Mass: 329.98513
• Heavy Atom Count: 19
• Complexity: 358

Purity/Quality:

95% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: COC(=O)CCC(=O)NC1=C(C=C(C=C1)[N+](=O)[O-])Br