CCOC(=O)COc1ccc(C(F)(F)F)cc1Br
SMILES: CCOC(=O)COc1ccc(C(F)(F)F)cc1Br

Molecular Processing

Molecular formula
C11H10BrF3O3
Molecular weight
327.1
Exact mass
325.9765
XLogP
3.41
TPSA
35.53
H-bond donors
0
H-bond acceptors
3
Rotatable bonds
4
Heavy atoms
18
Rings
1
Aromatic rings
1
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
7
Covalent units
1
Fraction Csp3
0.364
Molar refractivity
61.27

Supplementary Information

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