Basic information
- CAS
62198-20-3- Standard SMILES
N#CC1=CC(C#N)CC1- InChIKey
PHYFFWJVDADRAZ-UHFFFAOYSA-N- Molecular formula
- C7H6N2
- Average molar mass
- 118.14 g/mol
- Monoisotopic mass
- 118.0530982
Names & identifiers
- Preferred name
- Cyclopent-1-ene-1,3-dicarbonitrile
- IUPAC
- cyclopentene-1,3-dicarbonitrile
Names & synonyms
62198-20-3Cyclopent-1-ene-1,3-dicarbonitrileSCHEMBL820008DTXSID70495005
Database identifiers
- CAS
62198-20-3- PubChem CID
- 12374579
- DTXSID
DTXSID70495005
Properties
Computed structural properties
- XLogP
- 0.6
- Topological polar surface area
- 47.6 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 0
- Heavy atoms
- 9
- Formal charge
- 0
- Complexity
- 232
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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