CCOc1cc(Br)c(F)cn1
SMILES: CCOc1cc(Br)c(F)cn1

Molecular Processing

Molecular formula
C7H7BrFNO
Molecular weight
220.04
Exact mass
218.9695
XLogP
2.38
TPSA
22.12
H-bond donors
0
H-bond acceptors
2
Rotatable bonds
2
Heavy atoms
11
Rings
1
Aromatic rings
1
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
4
Covalent units
1
Fraction Csp3
0.286
Molar refractivity
43.06

Supplementary Information

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