3-Penten-2-one, 4-hydroxy-
Basic information
- CAS
1522-20-9- Standard SMILES
CC(=O)/C=C(/C)O- InChIKey
POILWHVDKZOXJZ-ARJAWSKDSA-N- Molecular formula
- C5H8O2
- Average molar mass
- 100.12 g/mol
- Monoisotopic mass
- 100.05242949
Overview
(3Z)-4-hydroxy-3-penten-2-one is an enone that is 3-penten-2-one carrying an additional hydroxy substituent at position 4. It is an enol and an enone.
Names & identifiers
- Preferred name
- 3-Penten-2-one, 4-hydroxy-
- IUPAC
- (Z)-4-hydroxypent-3-en-2-one
Names & synonyms
3-Penten-2-one, 4-hydroxy-1522-20-9RefChem:935731(Z)-4-hydroxypent-3-en-2-one(3Z)-4-hydroxypent-3-en-2-one26567-75-9(z)-4-hydroxy-3-penten-2-oneSCHEMBL3247Z-2-Pentene-4-one-2-olSCHEMBL8910437CHEBI:131370(3Z)-4-hydroxy-3-penten-2-one
Show more names
InChI=1/C5H8O2/c1-4(6)3-5(2)7/h3,6H,1-2H3/b4-3
Database identifiers
- CAS
1522-20-9- PubChem CID
- 643791
- ChEBI
CHEBI:131370- Nikkaji
- J740.117E、J765.535E
Properties
Computed structural properties
- XLogP
- 0.8
- Topological polar surface area
- 37.3 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 1
- Heavy atoms
- 7
- Formal charge
- 0
- Complexity
- 103
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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