Phenacyl formate
Basic information
- CAS
55153-12-3- Standard SMILES
O=COCC(=O)c1ccccc1- InChIKey
RJJPGLSTUHHJOX-UHFFFAOYSA-N- Molecular formula
- C9H8O3
- Average molar mass
- 164.16 g/mol
- Monoisotopic mass
- 164.04734411
Names & identifiers
- Preferred name
- Phenacyl formate
- IUPAC
- phenacyl formate
Names & synonyms
phenacyl formate55153-12-3DTXSID10341052RefChem:1094667DTXCID30292133Ethanone, 2-(formyloxy)-1-phenyl-2-Oxo-2-phenylethyl formate2-(Formyloxy)-1-phenylethanoneformyloxyacetophenoneSCHEMBL1282SCHEMBL12832-Oxo-2-phenylethyl formate #
Show more names
RJJPGLSTUHHJOX-UHFFFAOYSA-NG83884
Database identifiers
- CAS
55153-12-3- PubChem CID
- 569595
- DTXSID
DTXSID10341052- Nikkaji
- J146.501E
Properties
Computed structural properties
- XLogP
- 1.5
- Topological polar surface area
- 43.4 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 4
- Heavy atoms
- 12
- Formal charge
- 0
- Complexity
- 159
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…