3-Methoxy-4-nitrosoazobenzene
Basic information
- CAS
80830-32-6- Standard SMILES
COc1cc(N=Nc2ccccc2)ccc1N=O- InChIKey
WALFIZMABZBXTI-UHFFFAOYSA-N- Molecular formula
- C13H11N3O2
- Average molar mass
- 241.24 g/mol
- Monoisotopic mass
- 241.0851266
Names & identifiers
- Preferred name
- 3-Methoxy-4-nitrosoazobenzene
- IUPAC
- (3-methoxy-4-nitrosophenyl)-phenyldiazene
- English name
- 3-Methoxy-4-nitrosoazobenzene
- Molecular formula
- C13H11N3O2
- Molecular weight
- 241.25
Names & synonyms
80830-32-63-Methoxy-4-nitrosoazobenzeneAZOBENZENE, 3-METHOXY-4-NITROSO-SCHEMBL28543481SCHEMBL28543482DTXSID101040785Diazene, 1-(3-methoxy-4-nitrosophenyl)-2-phenyl-
Database identifiers
- CAS
80830-32-6- PubChem CID
- 54669
- DTXSID
DTXSID101040785- Nikkaji
- J84.802F
Properties
Computed structural properties
- XLogP
- 3
- Topological polar surface area
- 63.4 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 3
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 290
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Compound notes
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