Basic information
- CAS
33215-59-7- Standard SMILES
O=[N+]([O-])c1cccc(C=NOCc2cccc([N+](=O)[O-])c2)c1- InChIKey
RQZAENCTGVKDBU-UHFFFAOYSA-N- Molecular formula
- C14H11N3O5
- Average molar mass
- 301.25 g/mol
- Monoisotopic mass
- 301.06987046
Names & identifiers
- Preferred name
- m-Nitrobenzaldehyde O-(m-nitrobenzyl)oxime
- IUPAC
- 1-(3-nitrophenyl)-N-[(3-nitrophenyl)methoxy]methanimine
Names & synonyms
m-Nitrobenzaldehyde O-(m-nitrobenzyl)oximeDTXSID401350420
Database identifiers
- CAS
33215-59-7- PubChem CID
- 97541
- DTXSID
DTXSID401350420
Properties
Computed structural properties
- XLogP
- 3.1
- Topological polar surface area
- 113 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 4
- Heavy atoms
- 22
- Formal charge
- 0
- Complexity
- 418
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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