7-Chloro-6-hydroxy-2-(2-nitrophenyl)-5,8-quinolinedione

HCID 149149

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Basic information

CAS: 102072-71-9
Standard SMILES: O=C1C(=O)c2ccc(-c3ccccc3[N+](=O)[O-])nc2C(O)=C1Cl
InChIKey: HIHIFYROJHHLPL-UHFFFAOYSA-N
Molecular formula: C15H7ClN2O5
Average molar mass: 330.68 g/mol
Monoisotopic mass: 330.004349

Names & identifiers

Preferred name: 7-Chloro-6-hydroxy-2-(2-nitrophenyl)-5,8-quinolinedione
IUPAC: 7-chloro-8-hydroxy-2-(2-nitrophenyl)quinoline-5,6-dione

Names & synonyms

102072-71-97-Chloro-6-hydroxy-2-(2-nitrophenyl)-5,8-quinolinedione7-chloro-8-hydroxy-2-(2-nitrophenyl)quinoline-5,6-dioneDTXSID409070695,8-Quinolinedione, 7-chloro-6-hydroxy-2-(2-nitrophenyl)-

Database identifiers

CAS: 102072-71-9
PubChem CID: 149149
DTXSID: DTXSID40907069

Properties

Computed structural properties

XLogP: 2.1
Topological polar surface area: 113 Å²
Hydrogen bond donors: 1
Hydrogen bond acceptors: 6
Rotatable bonds: 1
Heavy atoms: 23
Formal charge: 0
Complexity: 585

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