Nombre: ethyl 3-(5-bromo-2-fluorophenyl)-2,2-difluoro-3-hydroxypropanoate
SMILES:
CCOC(=O)C(F)(F)C(O)c1cc(Br)ccc1FMolecular Processing
Molecular formula
C11H10BrF3O3
Molecular weight
327.1
Exact mass
325.9765
XLogP
2.82
TPSA
46.53
H-bond donors
1
H-bond acceptors
3
Rotatable bonds
4
Heavy atoms
18
Rings
1
Aromatic rings
1
Saturated rings
0
Aliphatic rings
0
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
7
Covalent units
1
Fraction Csp3
0.364
Molar refractivity
60.64
Supplementary Information
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