Structure Info
- Chemspace ID
- CSCS00009898844 (Synthesis)
- MFCD
- MFCD00045257
- IUPAC Name
- 1-chloroethyl 3-oxobutanoate
- Mol formula
- C6H9ClO3
- Mol weight
- 165 Da
- Catalog Number(s)
- BBV-39908755, CSC009898844, FCH1206721
- Copy structure to query editor
- SMILES
- INCHI
- INCHI key
- MOL
Properties
- LogP
- 0.99
- Heavy atoms count
- 10
- Rotatable bond count
- 4
- Number of rings
- 0
- Carbon bond saturation, Fsp3
- 0.666
- Polar surface area (Å)
- 43
- Hydrogen bond acceptors count
- 2
- Hydrogen bond donors count
- 0
- Zoom the structure
- CSCS00009898844
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