Structure Info
- Chemspace ID
- CSCS00011082370 (Synthesis)
- MFCD
- MFCD28047344
- IUPAC Name
- 5-bromo-1-ethoxy-5-methylcyclohexa-1,3-diene
- Mol formula
- C9H13BrO
- Mol weight
- 217 Da
- Catalog Number(s)
- BBV-79198458, CSC011082370, FCH3145416
- Copy structure to query editor
- SMILES
- INCHI
- INCHI key
- MOL
Properties
- LogP
- 2.1
- Heavy atoms count
- 11
- Rotatable bond count
- 2
- Number of rings
- 1
- Carbon bond saturation, Fsp3
- 0.555
- Polar surface area (Å)
- 9
- Hydrogen bond acceptors count
- 1
- Hydrogen bond donors count
- 0
- Zoom the structure
- CSCS00011082370
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