Basic information
- CAS
73148-70-6- Standard SMILES
N#C[C@@H](N)Cc1ccccc1- InChIKey
AVXNAHRDJXOJHT-VIFPVBQESA-N- Molecular formula
- C9H10N2
- Average molar mass
- 146.19 g/mol
- Monoisotopic mass
- 146.08439833
Names & identifiers
- Preferred name
- (2S)-2-amino-3-phenylpropanenitrile
- IUPAC
- (2S)-2-amino-3-phenylpropanenitrile
Names & synonyms
(2S)-2-amino-3-phenylpropanenitrile(S)-2-Amino-3-phenylpropanenitrile73148-70-6Phenylalanine nitrileT365NQ3WVE2-Amino-3-phenylpropanenitrile, (S)-(S)-2-amino-3-phenylpropiononitrileUNII-T365NQ3WVEBenzenepropanenitrile, alpha-amino-, (alphaS)-SCHEMBL2921309AVXNAHRDJXOJHT-VIFPVBQESA-NSMSSF-0617223
Show more names
F9995-1744(alphaS)-alpha-AminobenzenepropanenitrileBenzenepropanenitrile, alpha-amino-, (S)-CS-0112121(.ALPHA.S)-.ALPHA.-AMINOBENZENEPROPANENITRILEBENZENEPROPANENITRILE, .ALPHA.-AMINO-, (S)-BENZENEPROPANENITRILE, .ALPHA.-AMINO-, (.ALPHA.S)-
Database identifiers
- CAS
73148-70-6- PubChem CID
- 18436310
- UNII
- T365NQ3WVE
- Nikkaji
- J643.245J
Properties
Computed structural properties
- XLogP
- 1.1
- Topological polar surface area
- 49.8 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 2
- Heavy atoms
- 11
- Formal charge
- 0
- Complexity
- 150
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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