Structure Info
- Chemspace ID
- CSCS00009897441 (Synthesis)
- MFCD
- MFCD20625979
- IUPAC Name
- 1-chloro-2-isocyanatoethyl acetate
- Mol formula
- C5H6ClNO3
- Mol weight
- 164 Da
- Catalog Number(s)
- BBV-39906969, CSC009897441, FCH1205085
- Copy structure to query editor
- SMILES
- INCHI
- INCHI key
- MOL
Properties
- LogP
- 0.54
- Heavy atoms count
- 10
- Rotatable bond count
- 4
- Number of rings
- 0
- Carbon bond saturation, Fsp3
- 0.6
- Polar surface area (Å)
- 56
- Hydrogen bond acceptors count
- 3
- Hydrogen bond donors count
- 0
- Zoom the structure
- CSCS00009897441
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