CC(C)(C)S(=O)(=O)c1ccc([N+](=O)[O-])cc1C#N
SMILES: CC(C)(C)S(=O)(=O)c1ccc([N+](=O)[O-])cc1C#N

Molecular Processing

Molecular formula
C11H12N2O4S
Molecular weight
268.29
Exact mass
268.0518
XLogP
2.04
TPSA
101.07
H-bond donors
0
H-bond acceptors
5
Rotatable bonds
2
Heavy atoms
18
Rings
1
Aromatic rings
1
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
7
Covalent units
1
Fraction Csp3
0.364
Molar refractivity
64.75

Supplementary Information

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