5-Hydroxy-1H-benz(de)isoquinoline-1,3(2H)-dione
Basic information
- CAS
23204-41-3- Standard SMILES
O=C1NC(=O)c2cc(O)cc3cccc1c23- InChIKey
BJDNLARFUVNOND-UHFFFAOYSA-N- Molecular formula
- C12H7NO3
- Average molar mass
- 213.19 g/mol
- Monoisotopic mass
- 213.04259309
Names & identifiers
- Preferred name
- 5-Hydroxy-1H-benz(de)isoquinoline-1,3(2H)-dione
- IUPAC
- 5-hydroxybenzo[de]isoquinoline-1,3-dione
- English name
- 5-hydroxy-1H-benz[de]isoquinoline-1,3(2H)-dione
- Molecular formula
- C12H7NO3
- Molecular weight
- 213.18888
Names & synonyms
23204-41-35-Hydroxy-1H-benz(de)isoquinoline-1,3(2H)-dione5-hydroxybenzo[de]isoquinoline-1,3-dione3-Hydroxynaphthalimide5-hydroxy-1H-benz[de]isoquinoline-1,3(2H)-dioneEINECS 245-486-75-hydroxy-1h-benzo[de]isoquinoline-1,3(2h)-dioneOprea1_150367SCHEMBL5750580SCHEMBL8891852DTXSID40177785BJDNLARFUVNOND-UHFFFAOYSA-N
Show more names
NS00027378
Database identifiers
- CAS
23204-41-3- PubChem CID
- 90029
- DTXSID
DTXSID40177785- EC Number
- 245-486-7
- Nikkaji
- J318.425K
Properties
Computed structural properties
- XLogP
- 1.6
- Topological polar surface area
- 66.4 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 0
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 341
Experimental & physicochemical properties
Endocrine DisruptorsPotential endocrine disrupting compound
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Compound notes
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