CCOC(=O)C1=CC=C(C=C1)S(=O)(=O)[O-].[K+]
名称: potassium 4-ethoxycarbonylbenzenesulfonate
SMILES: CCOC(=O)C1=CC=C(C=C1)S(=O)(=O)[O-].[K+]

Molecular Processing

Molecular formula
C9H9KO5S
Molecular weight
268.33
Exact mass
267.9808
XLogP
-2.23
TPSA
83.5
H-bond donors
0
H-bond acceptors
5
Rotatable bonds
3
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
2
Fraction Csp3
0.222
Molar refractivity
50.36

Supplementary Information

InChIKey: ZJIGVNMWBLBMKC-UHFFFAOYSA-M
同義語
SCHEMBL1823369ZJIGVNMWBLBMKC-UHFFFAOYSA-Mpotassium 4-ethoxycarbonylbenzenesulfonate
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