COC(=O)c1ccc(S(C)(=O)=O)cc1I
SMILES: COC(=O)c1ccc(S(C)(=O)=O)cc1I

Molecular Processing

Molecular formula
C9H9IO4S
Molecular weight
340.14
Exact mass
339.9266
XLogP
1.48
TPSA
60.44
H-bond donors
0
H-bond acceptors
4
Rotatable bonds
2
Heavy atoms
15
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
0.222
Molar refractivity
63.61

Supplementary Information

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