Basic information
- Standard SMILES
C#CCOCc1ccc(CO)cc1- InChIKey
YPFAWYJISRGUSJ-UHFFFAOYSA-N- Molecular formula
- C11H12O2
- Average molar mass
- 176.21 g/mol
Names & identifiers
- Preferred name
- 4-[(2-Propynyloxy)methyl]benzyl alcohol
- IUPAC
- [4-(prop-2-ynoxymethyl)phenyl]methanol
Names & synonyms
SCHEMBL510248YPFAWYJISRGUSJ-UHFFFAOYSA-N4-[(2-propynyloxy)methyl]benzyl alcohol(4-Prop-2-ynyloxymethyl-phenyl)-methanol
Database identifiers
- PubChem CID
- 54520131
Properties
Computed structural properties
- XLogP
- 0.8
- Topological polar surface area
- 29.5 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 4
- Heavy atoms
- 13
- Formal charge
- 0
- Complexity
- 172
Related reactions
14 records
Compound notes
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