2-Oxazolidinone, 3-(4-hydroxyphenyl)-5-(2-propynyloxymethyl)-, acetate
Basic information
- CAS
49711-82-2- Standard SMILES
C#CCOCC1CN(c2ccc(OC(C)=O)cc2)C(=O)O1- InChIKey
YNRXSTTUNTYSDZ-UHFFFAOYSA-N- Molecular formula
- C15H15NO5
- Average molar mass
- 289.28 g/mol
- Monoisotopic mass
- 289.09502258
Names & identifiers
- Preferred name
- 2-Oxazolidinone, 3-(4-hydroxyphenyl)-5-(2-propynyloxymethyl)-, acetate
- IUPAC
- [4-[2-oxo-5-(prop-2-ynoxymethyl)-1,3-oxazolidin-3-yl]phenyl] acetate
Names & synonyms
BRN 056695749711-82-2Acetic acid, 4-(5-(2-propynyloxymethyl)-3-oxazolidinyl)phenyl ester2-Oxazolidinone, 3-(4-hydroxyphenyl)-5-(2-propynyloxymethyl)-, acetateRefChem:264657DTXSID909643644-(2-Oxo-5-{[(prop-2-yn-1-yl)oxy]methyl}-1,3-oxazolidin-3-yl)phenyl acetate
Database identifiers
- CAS
49711-82-2- PubChem CID
- 206356
- DTXSID
DTXSID90964364
Properties
Computed structural properties
- XLogP
- 1.2
- Topological polar surface area
- 65.1 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 6
- Heavy atoms
- 21
- Formal charge
- 0
- Complexity
- 433
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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