Benzenamine, N-(1H-indol-3-ylmethylene)-4-nitro-

Base Information

• Chemical Name: Benzenamine, N-(1H-indol-3-ylmethylene)-4-nitro-
• CAS No.: 111601-52-6
• Molecular Formula: C15H11N3O2
• Molecular Weight: 265.26700
• DSSTox Substance ID: DTXSID60425533
• ChEMBL ID: CHEMBL1866897
• Mol file: 111601-52-6.mol

Synonyms:Benzenamine, N-(1H-indol-3-ylmethylene)-4-nitro-;111601-52-6;CBMicro_017279;CHEMBL1866897;DTXSID60425533;CCG-6051;AKOS000530447;BIM-0017182.P001;MLS-0437563.0002

Chemical Property of Benzenamine, N-(1H-indol-3-ylmethylene)-4-nitro-

Chemical Property:

• Melting Point: 135 °C(Solv: ethanol (64-17-5); water (7732-18-5))
• Boiling Point: 523.4±30.0 °C(Predicted)
• PSA: 70.21000
• Density: 1.30±0.1 g/cm3(Predicted)
• LogP: 3.79550
• XLogP3: 3.3
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 2
• Exact Mass: 265.085126602
• Heavy Atom Count: 20
• Complexity: 372

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1=CC=C2C(=C1)C(=CN2)C=NC3=CC=C(C=C3)[N+](=O)[O-]