7-bromo-1,2,3,5-tetrahydro-4,1-benzoxazepine
Structure Info
- Chemspace ID
- CSSS00010984377 (In-Stock Screening Compounds)
- CAS
- 886756-68-9, 55223-26-2
- MFCD
- MFCD22571503
- IUPAC Name
- 7-bromo-1,2,3,5-tetrahydro-4,1-benzoxazepine
- Mol formula
- C9H10BrNO
- Mol weight
- 228 Da
- Catalog Number(s)
- A1058122, AA01E2HY, AX35938, BB4LS-EN300-1688951, BBV-95723750, BD01031473, CSC010984377, EN300-1688951, H61525, LKB75668, OR1071176, TX01E3QE, Y3139106, Y5186945, Z1861993262, ZXC389216
- Copy structure to query editor
- SMILES
- INCHI
- INCHI key
- MOL
Properties
- LogP
- 1.92
- Heavy atoms count
- 12
- Rotatable bond count
- 0
- Number of rings
- 2
- Carbon bond saturation, Fsp3
- 0.333
- Polar surface area (Å)
- 21
- Hydrogen bond acceptors count
- 2
- Hydrogen bond donors count
- 1
- Zoom the structure
- CSSS00010984377
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