[3-[(2-methyl-5-oxo-1,3-oxazolidin-4-ylidene)methyl]phenyl] Acetate
Basic information
- CAS
66866-71-5- Standard SMILES
CC(=O)Oc1cccc(C=C2NC(C)OC2=O)c1- InChIKey
BMUBLASDXSTABL-UHFFFAOYSA-N- Molecular formula
- C13H13NO4
- Average molar mass
- 247.25 g/mol
- Monoisotopic mass
- 247.0844579
Overview
See also: 4-(3-Acetoxybenzylidene)-2-methyl-5-oxazolidinone (annotation moved to).
Names & identifiers
- Preferred name
- [3-[(2-methyl-5-oxo-1,3-oxazolidin-4-ylidene)methyl]phenyl] Acetate
- IUPAC
- [3-[(2-methyl-5-oxo-1,3-oxazolidin-4-ylidene)methyl]phenyl] acetate
Names & synonyms
66866-71-53-((2-Methyl-5-oxooxazolidin-4-ylidene)methyl)phenyl acetate[3-[(2-methyl-5-oxo-1,3-oxazolidin-4-ylidene)methyl]phenyl] AcetateDTXSID403995813-[(2-METHYL-5-OXO-1,3-OXAZOLIDIN-4-YLIDENE)METHYL]PHENYL ACETATE
Database identifiers
- CAS
66866-71-5- PubChem CID
- 4124306
- DTXSID
DTXSID40399581
Properties
Computed structural properties
- XLogP
- 2.5
- Topological polar surface area
- 64.6 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 3
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 377
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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