Structure Info
- Chemspace ID
- CSMB00015481261 (Enamine MADE)
- CAS
- 1256256-00-4
- MFCD
- MFCD28405313
- IUPAC Name
- 6-bromo-5-fluoro-3,4-dihydro-2H-1,4-benzoxazine
- Mol formula
- C8H7BrFNO
- Mol weight
- 232 Da
- Catalog Number(s)
- 90427, 90427-0.25G, A019100738, A795824, AA00HI9V, AG00HICN, AG209994, AI16735, AQ16735, AR00HJ1N, BB4LS-BD443009, BBV-77651490, BD443009, BS-50718, CD11314576, CM633686, CS-0163072, CSC015481261, EN300-19457346, F693377, FCH3870350, GAC25600, HY-W109554, X207314, Y1226930
- Copy structure to query editor
- SMILES
- INCHI
- INCHI key
- MOL
Properties
- LogP
- 2.03
- Heavy atoms count
- 12
- Rotatable bond count
- 0
- Number of rings
- 2
- Carbon bond saturation, Fsp3
- 0.25
- Polar surface area (Å)
- 21
- Hydrogen bond acceptors count
- 2
- Hydrogen bond donors count
- 1
- Zoom the structure
- CSMB00015481261
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