Basic information
- Standard SMILES
O=CC(=O)c1ccc(OCc2ccccc2)c([N+](=O)[O-])c1- InChIKey
RXEAXTVACIUSPY-UHFFFAOYSA-N- Molecular formula
- C15H11NO5
- Average molar mass
- 285.25 g/mol
Names & identifiers
- Preferred name
- 4-Benzyloxy-3-nitrophenyl glyoxal
- IUPAC
- 2-(3-nitro-4-phenylmethoxyphenyl)-2-oxoacetaldehyde
Names & synonyms
SCHEMBL106614624-benzyloxy-3-nitrophenyl glyoxalRXEAXTVACIUSPY-UHFFFAOYSA-N
Database identifiers
- PubChem CID
- 20134172
Properties
Computed structural properties
- XLogP
- 2.6
- Topological polar surface area
- 89.2 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 5
- Heavy atoms
- 21
- Formal charge
- 0
- Complexity
- 386
Related reactions
7 records
Compound notes
Loading…