SMILES:
Fc1ccc(OCCBr)cc1Molecular Processing
Molecular formula
C8H8BrFO
Molecular weight
219.05
Exact mass
217.9743
XLogP
2.6
TPSA
9.23
H-bond donors
0
H-bond acceptors
1
Rotatable bonds
3
Heavy atoms
11
Rings
1
Aromatic rings
1
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
3
Covalent units
1
Fraction Csp3
0.25
Molar refractivity
45.69
Supplementary Information
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