Structure Info
- Chemspace ID
- CSMB15027751258 (Enamine MADE)
- IUPAC Name
- 1-cyanoethyl 2-(diethoxyphosphoryl)acetate
- Mol formula
- C9H16NO5P
- Mol weight
- 249 Da
- Catalog Number(s)
- BBV-1204392720, m_1458_25935408_483820, m_1458____25935408____483820
- Copy structure to query editor
- SMILES
- INCHI
- INCHI key
- MOL
Properties
- LogP
- 0.31
- Heavy atoms count
- 16
- Rotatable bond count
- 8
- Number of rings
- 0
- Carbon bond saturation, Fsp3
- 0.777
- Polar surface area (Å)
- 86
- Hydrogen bond acceptors count
- 3
- Hydrogen bond donors count
- 0
- Zoom the structure
- CSMB15027751258
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