Basic information
- Standard SMILES
C#CCOc1ccc(C(=O)CC)c(O)c1- InChIKey
HYUVYQNOTXGHLX-UHFFFAOYSA-N- Molecular formula
- C12H12O3
- Average molar mass
- 204.22 g/mol
Names & identifiers
- Preferred name
- 1-(2-Hydroxy4-prop-2-ynyloxy-phenyl)-propan-1-one
- IUPAC
- 1-(2-hydroxy-4-prop-2-ynoxyphenyl)propan-1-one
Names & synonyms
SCHEMBL1477681HYUVYQNOTXGHLX-UHFFFAOYSA-N1-(2-hydroxy4-prop-2-ynyloxy-phenyl)-propan-1-one1-(2-hydroxy-4-prop-2-ynyloxy-phenyl)-propan-1-one
Database identifiers
- PubChem CID
- 22482834
Properties
Computed structural properties
- XLogP
- 2.6
- Topological polar surface area
- 46.5 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 4
- Heavy atoms
- 15
- Formal charge
- 0
- Complexity
- 263
Related reactions
12 records
Compound notes
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