Basic information
- CAS
220018-16-6- Standard SMILES
N#Cc1ccc(Oc2cccc3cccnc23)cc1C#N- InChIKey
VGMCUPGUTYCSLQ-UHFFFAOYSA-N- Molecular formula
- C17H9N3O
- Average molar mass
- 271.27 g/mol
- Monoisotopic mass
- 271.07456192
Names & identifiers
- Preferred name
- Zinc00285422
- IUPAC
- 4-quinolin-8-yloxybenzene-1,2-dicarbonitrile
Names & synonyms
220018-16-6ZINC00285422DTXSID50354944RefChem:388649DTXCID503060044-(8-Quinolinyloxy)phthalonitrile1,2-Benzenedicarbonitrile, 4-(8-quinolinyloxy)-4-(quinolin-8-yloxy)phthalonitrile4-[(Quinolin-8-yl)oxy]benzene-1,2-dicarbonitrile4-(8-quinolinoxy)phthalonitrile4-(quinolin-8-yloxy)benzene-1,2-dicarbonitrileCambridge id 5162596
Show more names
Oprea1_181642Oprea1_264779STK388282AKOS000727967NCGC00341712-01ST451554004-(8-quinolyloxy)benzene-1,2-dicarbonitrileAB00275575-04
Database identifiers
- CAS
220018-16-6- PubChem CID
- 787356
- DTXSID
DTXSID50354944
Properties
Computed structural properties
- XLogP
- 3.2
- Topological polar surface area
- 69.7 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 2
- Heavy atoms
- 21
- Formal charge
- 0
- Complexity
- 459
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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