96-96-8 | 4-Methoxy-2-nitroaniline

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Description

• Catalog Number: AB44187
• Chemical Name: 4-Methoxy-2-nitroaniline
• CAS Number: 96-96-8
• Molecular Formula: C7H8N2O3
• Molecular Weight: 168.15
• MDL Number: MFCD00007152
• SMILES: COc1ccc(c(c1)[N+](=O)[O-])N
• NSC Number: 5509

Computed Properties

• Complexity: 169
• Covalently-Bonded Unit Count: 1
• Heavy Atom Count: 12
• Hydrogen Bond Acceptor Count: 4
• Hydrogen Bond Donor Count: 1
• Rotatable Bond Count: 1
• XLogP3: 1.9

Literature

• Electronic absorption and vibrational spectra and nonlinear optical properties of 4-methoxy-2-nitroaniline.

  Physical chemistry chemical physics : PCCP 20100828

• One- and two-electron reactivity of a tantalum(V) complex with a redox-active tris(amido) ligand.

  Journal of the American Chemical Society 20090311