Basic information
- CAS
119478-47-6- Standard SMILES
OC1c2ccc3ncccc3c2C2OC2C1O- InChIKey
HYOVVAPZJIOXEQ-UHFFFAOYSA-N- Molecular formula
- C13H11NO3
- Average molar mass
- 229.23 g/mol
- Monoisotopic mass
- 229.07389321
Names & identifiers
- Preferred name
- syn-7,8-Dihydroxy-9,10-epoxy-7,8,9,10-tetrahydrobenzo(f)quinoline
- IUPAC
- 14-oxa-6-azatetracyclo[8.5.0.02,7.013,15]pentadeca-1(10),2(7),3,5,8-pentaene-11,12-diol
Names & synonyms
119478-47-6syn-7,8-Dihydroxy-9,10-epoxy-7,8,9,10-tetrahydrobenzo(f)quinolineDTXSID709229871a,2,3,9c-tetrahydro[1]benzoxireno[2,3-f]quinoline-2,3-diol
Database identifiers
- CAS
119478-47-6- PubChem CID
- 147461
- DTXSID
DTXSID70922987
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
Loading…