Name: sulfonate ester
SMILES:
CS(=O)(=O)OCc1cc(=O)c(OCc2ccccc2)co1Molecular Processing
Molecular formula
C14H14O6S
Molecular weight
310.33
Exact mass
310.0511
XLogP
1.7
TPSA
82.81
H-bond donors
0
H-bond acceptors
6
Rotatable bonds
6
Heavy atoms
21
Rings
2
Aromatic rings
2
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
7
Covalent units
1
Fraction Csp3
0.214
Molar refractivity
75.38
Supplementary Information
Details werden geladen…
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