Basic information
- Standard SMILES
CCOC(=O)Cc1coc2cc(COC(C)=O)ccc12- InChIKey
WAFGCDBMWLKLRU-UHFFFAOYSA-N- Molecular formula
- C15H16O5
- Average molar mass
- 276.28 g/mol
- Monoisotopic mass
- 276.09977361
Names & identifiers
- Preferred name
- (6-Acetoxymethyl-benzofuran-3-yl)-acetic acid ethyl ester
- IUPAC
- ethyl 2-[6-(acetyloxymethyl)-1-benzofuran-3-yl]acetate
Names & synonyms
SCHEMBL3133285WAFGCDBMWLKLRU-UHFFFAOYSA-N(6-acetoxymethyl-benzofuran-3-yl)-acetic acid ethyl ester
Database identifiers
- PubChem CID
- 68523733
Properties
Computed structural properties
- XLogP
- 2.2
- Topological polar surface area
- 65.7 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 7
- Heavy atoms
- 20
- Formal charge
- 0
- Complexity
- 354
Related reactions
2 records
Compound notes
Loading…