Basic information
- Standard SMILES
CCOC(=O)c1coc(COC(C)=O)n1- InChIKey
VNIBNKCPLWLYNF-UHFFFAOYSA-N- Molecular formula
- C9H11NO5
- Average molar mass
- 213.19 g/mol
- Monoisotopic mass
- 213.06372245
Names & identifiers
- Preferred name
- Ethyl 2-[(acetyloxy)methyl]oxazole-4-carboxylate
- IUPAC
- ethyl 2-(acetyloxymethyl)-1,3-oxazole-4-carboxylate
Names & synonyms
SCHEMBL2113445VNIBNKCPLWLYNF-UHFFFAOYSA-Nethyl 2-[(acetyloxy)methyl]oxazole-4-carboxylate
Database identifiers
- PubChem CID
- 67280692
Properties
Computed structural properties
- XLogP
- 0.6
- Topological polar surface area
- 78.6 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 6
- Heavy atoms
- 15
- Formal charge
- 0
- Complexity
- 243
Related reactions
1 records
Compound notes
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