Basic information
- Standard SMILES
CC(=O)OCC=C(C)CO- InChIKey
WSBIBTVBOUYRGA-UHFFFAOYSA-N- Molecular formula
- C7H12O3
- Average molar mass
- 144.17 g/mol
- Monoisotopic mass
- 144.07864424
Names & identifiers
- Preferred name
- 4-Acetoxy-2-methyl-2-buten-1-ol
- IUPAC
- (4-hydroxy-3-methylbut-2-enyl) acetate
Names & synonyms
SCHEMBL9013663WSBIBTVBOUYRGA-UHFFFAOYSA-N4-acetoxy-2-methyl-2-buten-1-ol
Database identifiers
- PubChem CID
- 538222
Properties
Computed structural properties
- XLogP
- 0.4
- Topological polar surface area
- 46.5 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 4
- Heavy atoms
- 10
- Formal charge
- 0
- Complexity
- 138
Related reactions
5 records
Compound notes
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