SMILES:
Cc1cc(Br)ccc1SC1CC1Molecular Processing
Molecular formula
C10H11BrS
Molecular weight
243.17
Exact mass
241.9765
XLogP
4.01
TPSA
0
H-bond donors
0
H-bond acceptors
1
Rotatable bonds
2
Heavy atoms
12
Rings
2
Aromatic rings
1
Saturated rings
1
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
2
Covalent units
1
Fraction Csp3
0.4
Molar refractivity
57.76
Supplementary Information
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