SMILES:
CCCCOc1cc(S(=O)(=O)Cl)ccc1C#NMolecular Processing
Molecular formula
C11H12ClNO3S
Molecular weight
273.74
Exact mass
273.0226
XLogP
2.66
TPSA
67.16
H-bond donors
0
H-bond acceptors
4
Rotatable bonds
5
Heavy atoms
17
Rings
1
Aromatic rings
1
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
6
Covalent units
1
Fraction Csp3
0.364
Molar refractivity
64.6
Supplementary Information
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