Structure Info
- Chemspace ID
- CSMB00010983182 (Enamine MADE)
- MFCD
- MFCD00044116
- IUPAC Name
- 3-hydroxybutyl acetate
- Mol formula
- C6H12O3
- Mol weight
- 132 Da
- Catalog Number(s)
- 1851-86-1, ACM1851861, BBV-55247598, CSC010983182, EN300-7268533, FCH2493109, H010430, H473780, JH186387, PV-002839503821
- Copy structure to query editor
- SMILES
- INCHI
- INCHI key
- MOL
Properties
- LogP
- -0.29
- Heavy atoms count
- 9
- Rotatable bond count
- 4
- Number of rings
- 0
- Carbon bond saturation, Fsp3
- 0.833
- Polar surface area (Å)
- 47
- Hydrogen bond acceptors count
- 2
- Hydrogen bond donors count
- 1
- Zoom the structure
- CSMB00010983182
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