Basic information
- CAS
67557-68-0- Standard SMILES
CC(C#N)=C1Nc2ccccc2NC1=O- InChIKey
CZNKPMOKUDGGBA-UHFFFAOYSA-N- Molecular formula
- C11H9N3O
- Average molar mass
- 199.21 g/mol
- Monoisotopic mass
- 199.07456192
Names & identifiers
- Preferred name
- 2-(3-Oxo-1,4-dihydroquinoxalin-2-ylidene)propanenitrile
- IUPAC
- 2-(3-oxo-1,4-dihydroquinoxalin-2-ylidene)propanenitrile
Database identifiers
- CAS
67557-68-0- PubChem CID
- 330375
Properties
Computed structural properties
- XLogP
- 1.3
- Topological polar surface area
- 64.9 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 0
- Heavy atoms
- 15
- Formal charge
- 0
- Complexity
- 363
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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