NC(CO)(c1cc(Br)ccc1F)C(F)F
名称: 2-Amino-2-(5-bromo-2-fluoro-phenyl)-3,3-difluoro-propan-1-ol
SMILES: NC(CO)(c1cc(Br)ccc1F)C(F)F

Molecular Processing

Molecular formula
C9H9BrF3NO
Molecular weight
284.07
Exact mass
282.982
XLogP
2
TPSA
46.25
H-bond donors
2
H-bond acceptors
2
Rotatable bonds
3
Heavy atoms
15
Rings
1
Aromatic rings
1
Saturated rings
0
Aliphatic rings
0
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
6
Covalent units
1
Fraction Csp3
0.333
Molar refractivity
53.06

Supplementary Information

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