Molecule ID: 13243

IUPAC Name: (4-nitrophenyl) acetate

Description: The molecule is a phenyl acetate resulting from the formal condensation of the hydroxy group of 4-nitrophenol with the carboxy group of acetic acid. It is a member of phenyl acetates and a member of nitrobenzenes. It derives from a 4-nitrophenol.

SMILES: CC(=O)Oc1ccc([N+](=O)[O-])cc1

SELFIES: [C][C][=Branch1][C][=O][O][C][=C][C][=C][Branch1][=Branch1][N+1][=Branch1][C][=O][O-1][C][=C][Ring1][=Branch2]

InChI: InChI=1S/C8H7NO4/c1-6(10)13-8-4-2-7(3-5-8)9(11)12/h2-5H,1H3

Molecular Properties:
- Polar Surface Area: 72.1 Ų
- LogP: 1.5