p-Nitrobenzaldehyde O-(m-nitrobenzyl)oxime
Basic information
- CAS
33215-60-0- Standard SMILES
O=[N+]([O-])c1ccc(C=NOCc2cccc([N+](=O)[O-])c2)cc1- InChIKey
YAPIGDWFNPNBAO-UHFFFAOYSA-N- Molecular formula
- C14H11N3O5
- Average molar mass
- 301.25 g/mol
- Monoisotopic mass
- 301.06987046
Names & identifiers
- Preferred name
- p-Nitrobenzaldehyde O-(m-nitrobenzyl)oxime
- IUPAC
- 1-(4-nitrophenyl)-N-[(3-nitrophenyl)methoxy]methanimine
Names & synonyms
p-Nitrobenzaldehyde O-(m-nitrobenzyl)oximeDTXSID301350427
Database identifiers
- CAS
33215-60-0- PubChem CID
- 97542
- DTXSID
DTXSID301350427
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
- 410
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Compound notes
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