Basic information
- Standard SMILES
CCC1CCc2occc2C1=O- InChIKey
BFSYOMXFZPQFCT-UHFFFAOYSA-N- Molecular formula
- C10H12O2
- Average molar mass
- 164.2 g/mol
Names & identifiers
- Preferred name
- 5-ethyl-6,7-dihydro-1-benzofuran-4(5H)-one
- IUPAC
- 5-ethyl-6,7-dihydro-5H-1-benzofuran-4-one
Names & synonyms
5-ethyl-6,7-dihydro-1-benzofuran-4(5H)-oneSCHEMBL6101336BFSYOMXFZPQFCT-UHFFFAOYSA-N
Database identifiers
- PubChem CID
- 22147457
Properties
Computed structural properties
- XLogP
- 2.1
- Topological polar surface area
- 30.2 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 1
- Heavy atoms
- 12
- Formal charge
- 0
- Complexity
- 188
Related reactions
5 records
Compound notes
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