Anti-benzo[H]quinoline-7,8-diol-9,10-epoxide
Basic information
- CAS
113163-22-7- Standard SMILES
OC1c2ccc3cccnc3c2C2OC2C1O- InChIKey
UGQWYQLYNQTXMZ-UHFFFAOYSA-N- Molecular formula
- C13H11NO3
- Average molar mass
- 229.23 g/mol
- Monoisotopic mass
- 229.07389321
Names & identifiers
- Preferred name
- Anti-benzo[H]quinoline-7,8-diol-9,10-epoxide
- IUPAC
- 14-oxa-3-azatetracyclo[8.5.0.02,7.013,15]pentadeca-1(10),2(7),3,5,8-pentaene-11,12-diol
Names & synonyms
113163-22-7ANTI-BENZO[H]QUINOLINE-7,8-DIOL-9,10-EPOXIDEDTXSID409210031a,2,3,9c-Tetrahydro[1]benzoxireno[3,2-h]quinoline-2,3-diol
Database identifiers
- CAS
113163-22-7- PubChem CID
- 3036717
- DTXSID
DTXSID40921003
Properties
Computed structural properties
- XLogP
- 0
- Topological polar surface area
- 65.9 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 0
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 324
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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