Ethyl 2-(3-cyano-4-fluorophenyl)-2-oxoacetate
Structure Info
- Chemspace ID
- CSSB00010208453 (In-Stock Building Blocks)
- MFCD
- MFCD09801400, MFCD18830900
- IUPAC Name
- ethyl 2-(3-cyano-4-fluorophenyl)-2-oxoacetate
- Mol formula
- C11H8FNO3
- Mol weight
- 221 Da
- Catalog Number(s)
- 086372, A82484, AG01FDOD, AG238948, AGNPC-0WCBO8, AR01FEDD, BBV-77845454, BD503465, CD12002659, CSC010208453, FCH2824826, SC-32487, SMA38370, TX01FEU1, Y3623889
- Copy structure to query editor
- SMILES
- INCHI
- INCHI key
- MOL
Properties
- LogP
- 2.23
- Heavy atoms count
- 16
- Rotatable bond count
- 4
- Number of rings
- 1
- Carbon bond saturation, Fsp3
- 0.181
- Polar surface area (Å)
- 67
- Hydrogen bond acceptors count
- 3
- Hydrogen bond donors count
- 0
- Zoom the structure
- CSSB00010208453
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