3-Penten-2-one, 4-hydroxy-3-methyl-
Basic information
- CAS
1522-25-4- Standard SMILES
CC(=O)C(C)=C(C)O- InChIKey
ZBCJFUZOIPBJEF-UHFFFAOYSA-N- Molecular formula
- C6H10O2
- Average molar mass
- 114.14 g/mol
- Monoisotopic mass
- 114.06807956
Names & identifiers
- Preferred name
- 3-Penten-2-one, 4-hydroxy-3-methyl-
- IUPAC
- 4-hydroxy-3-methylpent-3-en-2-one
Names & synonyms
1522-25-44-hydroxy-3-methylpent-3-en-2-one3-Penten-2-one, 4-hydroxy-3-methyl-DTXSID302758004-hydroxy-3-methyl-pent-3-en-2-one
Database identifiers
- CAS
1522-25-4- PubChem CID
- 84287
- DTXSID
DTXSID30275800
Properties
Computed structural properties
- XLogP
- 1.1
- Topological polar surface area
- 37.3 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 1
- Heavy atoms
- 8
- Formal charge
- 0
- Complexity
- 133
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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