4-(Dipropylamino)benzonitrile
Basic information
- CAS
96795-43-6- Standard SMILES
CCCN(CCC)c1ccc(C#N)cc1- InChIKey
PYBOHBWNACIEDV-UHFFFAOYSA-N- Molecular formula
- C13H18N2
- Average molar mass
- 202.3 g/mol
- Monoisotopic mass
- 202.14699858
Names & identifiers
- Preferred name
- 4-(Dipropylamino)benzonitrile
- IUPAC
- 4-(dipropylamino)benzonitrile
Names & synonyms
96795-43-64-(dipropylamino)benzonitrileBenzonitrile, 4-(dipropylamino)-NSC151913SCHEMBL151232DTXSID10302567AKOS000217876NSC-151913DA-22218
Database identifiers
- CAS
96795-43-6- PubChem CID
- 289710
- DTXSID
DTXSID10302567- Nikkaji
- J68.584D
Properties
Computed structural properties
- XLogP
- 3.6
- Topological polar surface area
- 27 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 5
- Heavy atoms
- 15
- Formal charge
- 0
- Complexity
- 202
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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