2-({[(Z)-amino(4-amino-1,2,5-oxadiazol-3-yl)methylidene]amino}oxy)-N-(4-nitrophenyl)acetamide

Base Information

• Chemical Name: 2-({[(Z)-amino(4-amino-1,2,5-oxadiazol-3-yl)methylidene]amino}oxy)-N-(4-nitrophenyl)acetamide
• CAS No.: 5486-27-1
• Molecular Formula: C22H22 O11
• Molecular Weight: 321.2489
• DSSTox Substance ID: DTXSID20416447
• Mol file: 5486-27-1.mol

Synonyms:5486-27-1;AC1NSH2Q;DTXSID20416447;STK757681;AKOS001703852;SR-01000210747;SR-01000210747-1;2-({[(Z)-1-amino-1-(4-amino-1,2,5-oxadiazol-3-yl)methylidene]amino}oxy)-N~1~-(4-nitrophenyl)acetamide;2-({[(Z)-amino(4-amino-1,2,5-oxadiazol-3-yl)methylidene]amino}oxy)-N-(4-nitrophenyl)acetamide

Chemical Property of 2-({[(Z)-amino(4-amino-1,2,5-oxadiazol-3-yl)methylidene]amino}oxy)-N-(4-nitrophenyl)acetamide

Chemical Property:

• Boiling Point: °Cat760mmHg
• Flash Point: °C
• Density: 1.77g/cm³
• XLogP3: 0.5
• Hydrogen Bond Donor Count: 3
• Hydrogen Bond Acceptor Count: 9
• Rotatable Bond Count: 5
• Exact Mass: 321.08216648
• Heavy Atom Count: 23
• Complexity: 460

Purity/Quality:

99% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1=CC(=CC=C1NC(=O)CON=C(C2=NON=C2N)N)[N+](=O)[O-]
• Isomeric SMILES: C1=CC(=CC=C1NC(=O)CO/N=C(/C2=NON=C2N)\N)[N+](=O)[O-]