Structure Info
- Chemspace ID
- CSMB00030463319 (Enamine MADE)
- CAS
- 42844-38-2, 31930-34-4
- MFCD
- MFCD01566853, MFCD00674501
- IUPAC Name
- ethyl 3-bromoprop-2-enoate
- Mol formula
- C5H7BrO2
- Mol weight
- 179 Da
- Catalog Number(s)
- AB73990, AG003QEM, AJ73990, ArZ-UP187390, BB4LS-BD306270, BBV-79153572, CSC030463319, EN300-802913, LP018047, R184638, T70763, ZX-NM230665
- Copy structure to query editor
- SMILES
- INCHI
- INCHI key
- MOL
Properties
- LogP
- 1.75
- Heavy atoms count
- 8
- Rotatable bond count
- 3
- Number of rings
- 0
- Carbon bond saturation, Fsp3
- 0.4
- Polar surface area (Å)
- 26
- Hydrogen bond acceptors count
- 1
- Hydrogen bond donors count
- 0
- Zoom the structure
- CSMB00030463319
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