1H-Pyrrolizine-5-acetonitrile, 2,3-dihydro-6,7-diphenyl-
Basic information
- CAS
105577-50-2- Standard SMILES
N#CCc1c(-c2ccccc2)c(-c2ccccc2)c2n1CCC2- InChIKey
NDRPMVLSDKJCQQ-UHFFFAOYSA-N- Molecular formula
- C21H18N2
- Average molar mass
- 298.4 g/mol
- Monoisotopic mass
- 298.14699858
Names & identifiers
- Preferred name
- 1H-Pyrrolizine-5-acetonitrile, 2,3-dihydro-6,7-diphenyl-
- IUPAC
- 2-(1,2-diphenyl-6,7-dihydro-5H-pyrrolizin-3-yl)acetonitrile
Names & synonyms
105577-50-21H-Pyrrolizine-5-acetonitrile, 2,3-dihydro-6,7-diphenyl-NSC358525DTXSID30320364NSC-358525(6,7-Diphenyl-2,3-dihydro-1H-pyrrolizin-5-yl)acetonitrile
Database identifiers
- CAS
105577-50-2- PubChem CID
- 338012
- DTXSID
DTXSID30320364
Properties
Computed structural properties
- XLogP
- 4
- Topological polar surface area
- 28.7 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 3
- Heavy atoms
- 23
- Formal charge
- 0
- Complexity
- 438
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Compound notes
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