Basic information
- CAS
10135-17-8- Standard SMILES
O=C1OCCN1CCc1ccccc1- InChIKey
RPLYLMAFKHOGQD-UHFFFAOYSA-N- Molecular formula
- C11H13NO2
- Average molar mass
- 191.23 g/mol
- Monoisotopic mass
- 191.09462866
Names & identifiers
- Preferred name
- 3-(2-Phenylethyl)-1,3-oxazolidin-2-one
- IUPAC
- 3-(2-phenylethyl)-1,3-oxazolidin-2-one
- English name
- 3-phenethyloxazolidin-2-one
- Molecular formula
- C11H13NO2
- Molecular weight
- 191.23
Names & synonyms
3-(2-phenylethyl)-1,3-oxazolidin-2-one10135-17-83-PHENETHYLOXAZOLIDIN-2-ONENSC44460SCHEMBL28498829DTXSID60286247NSC-444602-Oxazolidinone, 3-(2-phenylethyl)-
Database identifiers
- CAS
10135-17-8- PubChem CID
- 239408
- DTXSID
DTXSID60286247
Properties
Computed structural properties
- XLogP
- 1.9
- Topological polar surface area
- 29.5 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 3
- Heavy atoms
- 14
- Formal charge
- 0
- Complexity
- 199
Physicochemical properties
- Melting point
- 63 · 63.0-64.5 °C
- Boiling point
- 398.8 · 398.8±21.0 °C(Predicted)
- Density
- 1.154 · 1.154±0.06 g/cm3(Predicted)
- pka
- -1.43 · -1.43±0.20(Predicted)
Chemistry & industry
Suppliers1 total
HONEST JOY HOLDINGS LIMITED[email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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