SMILES:
Clc1ccccc1SC1CCCC1Molecular Processing
Molecular formula
C11H13ClS
Molecular weight
212.74
Exact mass
212.0426
XLogP
4.37
TPSA
0
H-bond donors
0
H-bond acceptors
1
Rotatable bonds
2
Heavy atoms
13
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
0.455
Molar refractivity
59.57
Supplementary Information
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