Acetic acid 3-chloromethyl-benzofuran-6-yl ester
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Basic information
- Standard SMILES
CC(=O)Oc1ccc2c(CCl)coc2c1- InChIKey
PVPUAUFTEBGGAJ-UHFFFAOYSA-N- Molecular formula
- C11H9ClO3
- Average molar mass
- 224.64 g/mol
Names & identifiers
- Preferred name
- Acetic acid 3-chloromethyl-benzofuran-6-yl ester
- IUPAC
- [3-(chloromethyl)-1-benzofuran-6-yl] acetate
Names & synonyms
SCHEMBL743266PVPUAUFTEBGGAJ-UHFFFAOYSA-NAcetic acid 3-chloromethyl-benzofuran-6-yl ester
Database identifiers
- PubChem CID
- 59577463
Properties
Computed structural propertiesFilling in
- XLogP
- 2.5
- Topological polar surface area
- 39.4 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 3
- Heavy atoms
- 15
- Formal charge
- 0
- Complexity
- 244
Related reactions
3 records
Compound notes
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