7-bromo-9-fluoro-2,3,4,5-tetrahydro-1-benzoxepin-5-one
Structure Info
- Chemspace ID
- CSSS00011265726 (In-Stock Screening Compounds)
- CAS
- 1094253-85-6, 26131-68-0
- MFCD
- MFCD11207541
- IUPAC Name
- 7-bromo-9-fluoro-2,3,4,5-tetrahydro-1-benzoxepin-5-one
- Mol formula
- C10H8BrFO2
- Mol weight
- 259 Da
- Catalog Number(s)
- BB4LS-EN300-3258966, BBV-5105888, BD01522073, BL80646, BVV-820864860, CS-0246423, CSC011265726, EN300-3258966, HY-W185367, IMED385054291, TX0292H6, Y3191923, Z384973054, ZXC253318
- Copy structure to query editor
- SMILES
- INCHI
- INCHI key
- MOL
Properties
- LogP
- 2.51
- Heavy atoms count
- 14
- Rotatable bond count
- 0
- Number of rings
- 2
- Carbon bond saturation, Fsp3
- 0.3
- Polar surface area (Å)
- 26
- Hydrogen bond acceptors count
- 2
- Hydrogen bond donors count
- 0
- Zoom the structure
- CSSS00011265726
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