Basic information
- CAS
80096-54-4- Standard SMILES
C[C@@H](N)C(=O)c1ccccc1- InChIKey
PUAQLLVFLMYYJJ-SSDOTTSWSA-N- Molecular formula
- C9H11NO
- Average molar mass
- 149.19 g/mol
- Monoisotopic mass
- 149.08406397
Names & identifiers
- Preferred name
- Cathinone, (+)-
- IUPAC
- (2R)-2-amino-1-phenylpropan-1-one
Names & synonyms
(+)-CathinoneCathinone, (+)-1-Propanone, 2-amino-1-phenyl-, (R)-UNII-93UQ761V5A(R)-(+)-CathinoneBRN 524701693UQ761V5A1-Propanone, 2-amino-1-phenyl-, (2R)-(R)-CATHINONEDTXSID90230076RefChem:200090DTXCID90152567
Show more names
80096-54-4(2R)-2-amino-1-phenylpropan-1-oneCHEMBL3301840SCHEMBL20095234SCHEMBL27338904Q27271614
Database identifiers
- CAS
80096-54-4- PubChem CID
- 149798
- DTXSID
DTXSID90230076- ChEMBL
CHEMBL3301840- UNII
- 93UQ761V5A
- Nikkaji
- J543.577C
Properties
Computed structural properties
- XLogP
- 1.1
- Topological polar surface area
- 43.1 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 2
- Heavy atoms
- 11
- Formal charge
- 0
- Complexity
- 138
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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