(4-Methylphenyl)(4-nitrophenyl)diazene

HCID 34575

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Basic information

CAS: 29418-58-4
Standard SMILES: Cc1ccc(N=Nc2ccc([N+](=O)[O-])cc2)cc1
InChIKey: ILLZCQXUVXWGJA-UHFFFAOYSA-N
Molecular formula: C13H11N3O2
Average molar mass: 241.24 g/mol
Monoisotopic mass: 241.0851266

Names & identifiers

Preferred name: (4-Methylphenyl)(4-nitrophenyl)diazene
IUPAC: (4-methylphenyl)-(4-nitrophenyl)diazene

Names & synonyms

29418-58-4(4-METHYLPHENYL)(4-NITROPHENYL)DIAZENE32968-59-5SCHEMBL13869758Azobenzene, 4-methyl-4'-nitro-ILLZCQXUVXWGJA-CCEZHUSRSA-NDTXSID001038761STK672564AKOS0055928931-(4-methylphenyl)-2-(4-nitrophenyl)diazene(E)-1-(4-Methylphenyl)-2-(4-nitrophenyl)diazene(E)-1-(4-Methylphenyl)-2-(4-nitrophenyl)diazene #

Show more names

Diazene, 1-(4-methylphenyl)-2-(4-nitrophenyl)-, (1E)-

Database identifiers

CAS: 29418-58-4、32968-59-5
PubChem CID: 34575
DTXSID: DTXSID001038761
Nikkaji: J959.886C

Properties

Computed structural properties

XLogP: 4.1
Topological polar surface area: 70.5 Å²
Hydrogen bond donors: 0
Hydrogen bond acceptors: 4
Rotatable bonds: 2
Heavy atoms: 18
Formal charge: 0
Complexity: 298

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