Basic information
- CAS
2138-32-1- Standard SMILES
CN(C)CCC(=O)c1ccccc1O- InChIKey
KIEOSMNUIUKKQZ-UHFFFAOYSA-N- Molecular formula
- C11H15NO2
- Average molar mass
- 193.24 g/mol
- Monoisotopic mass
- 193.11027872
Names & identifiers
- Preferred name
- 3-(Dimethylamino)-1-(2-hydroxyphenyl)propan-1-one
- IUPAC
- 3-(dimethylamino)-1-(2-hydroxyphenyl)propan-1-one
Names & synonyms
3-(dimethylamino)-1-(2-hydroxyphenyl)propan-1-one2138-32-1DTXSID70275728RefChem:275418DTXCID90201004SCHEMBL47596525KL
Database identifiers
- CAS
2138-32-1- PubChem CID
- 74229
- DTXSID
DTXSID70275728- Nikkaji
- J1.702.343H
Properties
Computed structural properties
- XLogP
- 2
- Topological polar surface area
- 40.5 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 4
- Heavy atoms
- 14
- Formal charge
- 0
- Complexity
- 192
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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