Basic information
- Standard SMILES
CC#CCOc1ccc2c(c1)CCO2- InChIKey
RIRLHXRNJQSXDU-UHFFFAOYSA-N- Molecular formula
- C12H12O2
- Average molar mass
- 188.22 g/mol
Names & identifiers
- Preferred name
- 5-(But-2-ynyloxy)-2,3-dihydrobenzofuran
- IUPAC
- 5-but-2-ynoxy-2,3-dihydro-1-benzofuran
Names & synonyms
5-(but-2-ynyloxy)-2,3-dihydrobenzofuranSCHEMBL1276665RIRLHXRNJQSXDU-UHFFFAOYSA-N
Database identifiers
- PubChem CID
- 66974009
Properties
Computed structural properties
- XLogP
- 2.5
- Topological polar surface area
- 18.5 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 2
- Heavy atoms
- 14
- Formal charge
- 0
- Complexity
- 248
Related reactions
1 records
Compound notes
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