Molecule ID: 126843460

IUPAC Name: N-hydroxy-2-phenylethanimine oxide

Description: The molecule is an aci-nitro compound resulting from the formal tautomerisation of the nitro group of (2-nitroethyl)benzene. It is an aci-nitro compound and a member of benzenes.

SMILES: [O-][N+](O)=CCc1ccccc1

SELFIES: [O-1][N+1][Branch1][C][O][=C][C][C][=C][C][=C][C][=C][Ring1][=Branch1]

InChI: InChI=1S/C8H9NO2/c10-9(11)7-6-8-4-2-1-3-5-8/h1-5,7H,6H2,(H,10,11)

Molecular Properties:
- Polar Surface Area: 49.0 Ų
- LogP: 1.0