Basic information
- CAS
5172-62-3- Standard SMILES
CON=Cc1ccc([N+](=O)[O-])cc1- InChIKey
ONZBYRQWJOKYPR-UHFFFAOYSA-N- Molecular formula
- C8H8N2O3
- Average molar mass
- 180.16 g/mol
- Monoisotopic mass
- 180.05349212
Names & identifiers
- Preferred name
- N-methoxy-1-(4-nitrophenyl)methanimine
- IUPAC
- N-methoxy-1-(4-nitrophenyl)methanimine
Names & synonyms
5172-62-3N-methoxy-1-(4-nitrophenyl)methanimineSCHEMBL9841029DTXSID109660074-nitro-benzaldehyde O-methyloxime
Database identifiers
- CAS
5172-62-3- PubChem CID
- 296641
- DTXSID
DTXSID10966007
Properties
Computed structural properties
- XLogP
- 2.3
- Topological polar surface area
- 67.4 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 2
- Heavy atoms
- 13
- Formal charge
- 0
- Complexity
- 192
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…