Basic information
- Standard SMILES
CCOC(=O)Cc1coc2ccc(Cl)cc12- InChIKey
LBIXBLUEEXMFCO-UHFFFAOYSA-N- Molecular formula
- C12H11ClO3
- Average molar mass
- 238.66 g/mol
Names & identifiers
- Preferred name
- Ethyl(5-chloro-1-benzofuran-3-yl)acetate
- IUPAC
- ethyl 2-(5-chloro-1-benzofuran-3-yl)acetate
Names & synonyms
LBIXBLUEEXMFCO-UHFFFAOYSA-Nethyl(5-chloro-1-benzofuran-3-yl)acetateethyl(5-chloro -1-benzofuran-3-yl)acetate
Database identifiers
- PubChem CID
- 12936153
Properties
Computed structural properties
- XLogP
- 3.1
- Topological polar surface area
- 39.4 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 4
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 257
Related reactions
6 records
Compound notes
Loading…