10-Hydroxybenzo[g]quinoline-5,6,9(1H)-trione
Basic information
- CAS
3712-11-6- Standard SMILES
O=C1c2cccnc2C(=O)c2c(O)ccc(O)c21- InChIKey
AFDMGIUNNDWCBX-UHFFFAOYSA-N- Molecular formula
- C13H7NO4
- Average molar mass
- 241.2 g/mol
- Monoisotopic mass
- 241.0375077
Names & identifiers
- Preferred name
- 10-Hydroxybenzo[g]quinoline-5,6,9(1H)-trione
- IUPAC
- 6,9-dihydroxybenzo[g]quinoline-5,10-dione
Names & synonyms
3712-11-6NSC10151010-Hydroxybenzo[g]quinoline-5,6,9(1H)-trioneNCIOpen2_006839CHEMBL14764SCHEMBL8545907DTXSID10420275NSC-101510
Database identifiers
- CAS
3712-11-6- PubChem CID
- 418494
- DTXSID
DTXSID10420275- ChEMBL
CHEMBL14764
Properties
Computed structural properties
- XLogP
- 2.5
- Topological polar surface area
- 87.5 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 0
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 383
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Compound notes
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