SMILES:
CS(=O)(=O)OCCc1cccc([N+](=O)[O-])c1Molecular Processing
Molecular formula
C9H11NO5S
Molecular weight
245.26
Exact mass
245.0358
XLogP
1.11
TPSA
86.51
H-bond donors
0
H-bond acceptors
5
Rotatable bonds
5
Heavy atoms
16
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
0.333
Molar refractivity
57.6
Supplementary Information
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