SMILES:
CCCSc1cc(F)cc(Br)c1Molecular Processing
Molecular formula
C9H10BrFS
Molecular weight
249.15
Exact mass
247.9671
XLogP
4.09
TPSA
0
H-bond donors
0
H-bond acceptors
1
Rotatable bonds
3
Heavy atoms
12
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
0.333
Molar refractivity
55.12
Supplementary Information
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