Basic information
- Standard SMILES
N#CCC(=O)c1ccc(C#N)o1- InChIKey
DGVWWJMFNVRARI-UHFFFAOYSA-N- Molecular formula
- C8H4N2O2
- Average molar mass
- 160.13 g/mol
Names & identifiers
- Preferred name
- 5-Cyanoacetyl-furan-2-carbonitrile
- IUPAC
- 5-(2-cyanoacetyl)furan-2-carbonitrile
Names & synonyms
SCHEMBL6443012DGVWWJMFNVRARI-UHFFFAOYSA-N5-cyanoacetyl-furan-2-carbonitrile
Database identifiers
- PubChem CID
- 18507555
Properties
Computed structural properties
- XLogP
- 0.9
- Topological polar surface area
- 77.8 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 2
- Heavy atoms
- 12
- Formal charge
- 0
- Complexity
- 280
Related reactions
3 records
Compound notes
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