Basic information
- CAS
147491-61-0- Standard SMILES
CCCC12CCC(C1)C(C#N)(C#N)C2(C#N)C#N- InChIKey
VIZVDNDMMQFUSE-UHFFFAOYSA-N- Molecular formula
- C14H14N4
- Average molar mass
- 238.29 g/mol
- Monoisotopic mass
- 238.12184646
Names & identifiers
- Preferred name
- 1-Propylbicyclo[2.2.1]heptane-2,2,3,3-tetracarbonitrile
- IUPAC
- 1-propylbicyclo[2.2.1]heptane-2,2,3,3-tetracarbonitrile
Names & synonyms
DTXSID1012063491-Propylbicyclo[2.2.1]heptane-2,2,3,3-tetracarbonitrile147491-61-0
Database identifiers
- CAS
147491-61-0- PubChem CID
- 85683026
- DTXSID
DTXSID101206349
Properties
Computed structural properties
- XLogP
- 2.4
- Topological polar surface area
- 95.2 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 2
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 548
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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