Ethyl 4-acetyl-5-methoxy-3-methyl-1-benzofuran-2-carboxylate
Basic information
- CAS
53725-07-8- Standard SMILES
CCOC(=O)c1oc2ccc(OC)c(C(C)=O)c2c1C- InChIKey
DNJXQGLYNGXERD-UHFFFAOYSA-N- Molecular formula
- C15H16O5
- Average molar mass
- 276.28 g/mol
- Monoisotopic mass
- 276.09977361
Names & identifiers
- Preferred name
- Ethyl 4-acetyl-5-methoxy-3-methyl-1-benzofuran-2-carboxylate
- IUPAC
- ethyl 4-acetyl-5-methoxy-3-methyl-1-benzofuran-2-carboxylate
Names & synonyms
53725-07-8ethyl 4-acetyl-5-methoxy-3-methyl-1-benzofuran-2-carboxylateNSC205083DTXSID50308583NSC-205083
Database identifiers
- CAS
53725-07-8- PubChem CID
- 307227
- DTXSID
DTXSID50308583
Properties
Computed structural properties
- XLogP
- 2.9
- Topological polar surface area
- 65.7 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 5
- Heavy atoms
- 20
- Formal charge
- 0
- Complexity
- 380
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Compound notes
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