Basic information
- CAS
6250-12-0- Standard SMILES
Oc1ccc2c(c1)CC[N+]1=C2CCC2CCCC21- InChIKey
AFZUMYMXNCDSQR-UHFFFAOYSA-O- Molecular formula
- C16H20NO+
- Average molar mass
- 242.34 g/mol
- Monoisotopic mass
- 242.15448926
Names & identifiers
- Preferred name
- Quindonium
- IUPAC
- 10-azoniatetracyclo[8.7.0.02,7.011,15]heptadeca-1(10),2(7),3,5-tetraen-5-ol
Names & synonyms
QuindoniumQuindonium ionQuindonium cationNCIOpen2_008715CHEMBL2009296SCHEMBL29387960DTXSID50861784NCI60_0417346250-12-08-Hydroxy-2,3,3a,5,6,11,12,12a-octahydro-1H-cyclopenta[5,6]pyrido[2,1-a]isoquinolin-4-ium
Database identifiers
- CAS
6250-12-0- PubChem CID
- 8544
- DTXSID
DTXSID50861784- ChEMBL
CHEMBL2009296
Properties
Computed structural properties
- XLogP
- 2.3
- Topological polar surface area
- 23.2 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 0
- Heavy atoms
- 18
- Formal charge
- 1
- Complexity
- 375
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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