Name: t-butylsulfonylacetonitrile
SMILES:
CC(C)(C)S(=O)(=O)CC#NMolecular Processing
Molecular formula
C6H11NO2S
Molecular weight
161.23
Exact mass
161.051
XLogP
0.72
TPSA
57.93
H-bond donors
0
H-bond acceptors
3
Rotatable bonds
1
Heavy atoms
10
Rings
0
Aromatic rings
0
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
4
Covalent units
1
Fraction Csp3
0.833
Molar refractivity
39.15
Supplementary Information
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Involved in 3 reactions→