SMILES:
CCOC(=O)c1ccc(CBr)c(C(F)(F)F)c1Molecular Processing
Molecular formula
C11H10BrF3O2
Molecular weight
311.1
Exact mass
309.9816
XLogP
3.78
TPSA
26.3
H-bond donors
0
H-bond acceptors
2
Rotatable bonds
3
Heavy atoms
17
Rings
1
Aromatic rings
1
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
6
Covalent units
1
Fraction Csp3
0.364
Molar refractivity
60.03
Supplementary Information
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