2-Methoxy-4-nitroazobenzene

HCID 46552

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Basic information

CAS: 64042-15-5
Standard SMILES: COc1cc([N+](=O)[O-])ccc1N=Nc1ccccc1
InChIKey: KTFBYPAJVPDRGB-UHFFFAOYSA-N
Molecular formula: C13H11N3O3
Average molar mass: 257.24 g/mol
Monoisotopic mass: 257.08004122

Names & identifiers

Preferred name: 2-Methoxy-4-nitroazobenzene
IUPAC: (2-methoxy-4-nitrophenyl)-phenyldiazene
English name: 2-METHOXY-4-NITROAZOBENZENE
Molecular formula: C13H11N3O3
Molecular weight: 257.24

Names & synonyms

2-Methoxy-4-nitroazobenzene64042-15-5Diazene, (2-methoxy-4-nitrophenyl)phenyl-Diazene, 1-(2-methoxy-4-nitrophenyl)-2-phenyl-(2-Methoxy-4-nitrophenyl)phenyldiazene(2-methoxy-4-nitrophenyl)-phenyldiazeneAZOBENZENE, 2-METHOXY-4-NITRO-ZH5KNF3DQDMethoxy-4-nitroazobenzene, 2-SCHEMBL28543338SCHEMBL28543339DTXSID501039164

Show more names

DB-2932311-(2-Methoxy-4-nitrophenyl)-2-phenyldiazene

Database identifiers

CAS: 64042-15-5
PubChem CID: 46552
DTXSID: DTXSID501039164
UNII: ZH5KNF3DQD
Nikkaji: J62.414D

Properties

Computed structural properties

XLogP: 3.5
Topological polar surface area: 79.8 Å²
Hydrogen bond donors: 0
Hydrogen bond acceptors: 5
Rotatable bonds: 3
Heavy atoms: 19
Formal charge: 0
Complexity: 324

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