4-{(E)-[(3-Nitrophenyl)methylidene]amino}aniline

Base Information

• Chemical Name: 4-{(E)-[(3-Nitrophenyl)methylidene]amino}aniline
• CAS No.: 28801-00-5
• Molecular Formula: C13H11N3O2
• DSSTox Substance ID: DTXSID90554986
• Nikkaji Number: J1.018.248D
• Mol file: 28801-00-5.mol

Synonyms:28801-00-5;n-(3-nitrobenzylidene)-p-phenylenediamine;4-{(E)-[(3-Nitrophenyl)methylidene]amino}aniline;SCHEMBL5790069;SCHEMBL6430523;DTXSID90554986;1,4-Benzenediamine N-[(3-nitrophenyl)methylene]

Chemical Property of 4-{(E)-[(3-Nitrophenyl)methylidene]amino}aniline

Chemical Property:

• XLogP3: 2.4
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 2
• Exact Mass: 241.085126602
• Heavy Atom Count: 18
• Complexity: 306

Purity/Quality:

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MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1=CC(=CC(=C1)[N+](=O)[O-])C=NC2=CC=C(C=C2)N

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