Basic information
- CAS
860444-83-3- Standard SMILES
COCC(=O)C(O)c1ccccc1- InChIKey
RQDLBCJMSZYAPT-UHFFFAOYSA-N- Molecular formula
- C10H12O3
- Average molar mass
- 180.2 g/mol
- Monoisotopic mass
- 180.07864424
Names & identifiers
- Preferred name
- 1-Hydroxy-3-methoxy-1-phenyl-2-propanone
- IUPAC
- 1-hydroxy-3-methoxy-1-phenylpropan-2-one
Names & synonyms
DTXSID5012756571-Hydroxy-3-methoxy-1-phenyl-2-propanone1-Hydroxy-3-methoxy-1-phenylpropan-2-one860444-83-3
Database identifiers
- CAS
860444-83-3- PubChem CID
- 103458043
- DTXSID
DTXSID501275657
Properties
Computed structural properties
- XLogP
- 0.9
- Topological polar surface area
- 46.5 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 4
- Heavy atoms
- 13
- Formal charge
- 0
- Complexity
- 162
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…