Name: (S)-1-amino-2-(5-bromo-2-fluoro-phenyl)-propan-2-ol
SMILES:
C[C@@](O)(CN)c1cc(Br)ccc1FMolecular Processing
Molecular formula
C9H11BrFNO
Molecular weight
248.09
Exact mass
247.0008
XLogP
1.75
TPSA
46.25
H-bond donors
2
H-bond acceptors
2
Rotatable bonds
2
Heavy atoms
13
Rings
1
Aromatic rings
1
Saturated rings
0
Aliphatic rings
0
Stereo centers
1
Undefined stereo
0
Formal charge
0
Heteroatoms
4
Covalent units
1
Fraction Csp3
0.333
Molar refractivity
52.73
Supplementary Information
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Involved in 10 reactions→