Basic information
- CAS
52597-15-6- Standard SMILES
CC(C)NC(C)C(=O)c1ccccc1- InChIKey
LWRDNIQTNMVTBK-UHFFFAOYSA-N- Molecular formula
- C12H17NO
- Average molar mass
- 191.27 g/mol
- Monoisotopic mass
- 191.13101417
Names & identifiers
- Preferred name
- 2-Isopropylamino-1-phenyl-propan-1-one
- IUPAC
- 1-phenyl-2-(propan-2-ylamino)propan-1-one
Names & synonyms
2-isopropylamino-1-phenyl-propan-1-one52597-15-6alpha-Iso-propylaminopropiophenoneDTXSID0013452392-(isopropylamino)-1-phenyl-propan-1-one
Database identifiers
- CAS
52597-15-6- PubChem CID
- 458522
- DTXSID
DTXSID001345239
Properties
Computed structural properties
- XLogP
- 2.4
- Topological polar surface area
- 29.1 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 4
- Heavy atoms
- 14
- Formal charge
- 0
- Complexity
- 183
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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