Basic information
- CAS
6687-88-3- Standard SMILES
N#CC(C#N)=CN1CCNc2ccccc21- InChIKey
XXIPPLGEGYAZAI-UHFFFAOYSA-N- Molecular formula
- C12H10N4
- Average molar mass
- 210.23 g/mol
- Monoisotopic mass
- 210.09054634
Names & identifiers
- Preferred name
- (3,4-Dihydroquinoxalin-1(2h)-ylmethylidene)propanedinitrile
- IUPAC
- 2-(3,4-dihydro-2H-quinoxalin-1-ylmethylidene)propanedinitrile
Names & synonyms
6687-88-32-((3,4-Dihydroquinoxalin-1(2H)-yl)methylene)malononitrile2-[(1,2,3,4-tetrahydroquinoxalin-1-yl)methylidene]propanedinitrile(3,4-dihydroquinoxalin-1(2h)-ylmethylidene)propanedinitrileNSC89863NCIOpen2_006220DTXSID20293492NSC-89863[(3,4-Dihydroquinoxalin-1(2H)-yl)methylidene]propanedinitrile
Database identifiers
- CAS
6687-88-3- PubChem CID
- 259708
- DTXSID
DTXSID20293492
Properties
Computed structural properties
- XLogP
- 1.6
- Topological polar surface area
- 62.9 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 1
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 362
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…