Basic information
- CAS
108805-69-2- Standard SMILES
COc1ccc(N=O)c(Nc2ccccc2)c1- InChIKey
IDEVHVNWLUTWEJ-UHFFFAOYSA-N- Molecular formula
- C13H12N2O2
- Average molar mass
- 228.25 g/mol
- Monoisotopic mass
- 228.08987763
Names & identifiers
- Preferred name
- 5-Methoxy-2-nitroso-N-phenylaniline
- IUPAC
- 5-methoxy-2-nitroso-N-phenylaniline
Names & synonyms
5-Methoxy-2-nitroso-N-phenylaniline108805-69-2DTXSID40545304RefChem:303767DTXCID40496089benzenamine,5-methoxy-2-nitroso-n-phenyl-
Database identifiers
- CAS
108805-69-2- PubChem CID
- 13625901
- DTXSID
DTXSID40545304
Properties
Computed structural properties
- XLogP
- 3.4
- Topological polar surface area
- 50.7 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 3
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 242
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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