CC(=O)CC(O)C(O)COS(=O)(=O)c1ccc(C)cc1
SMILES: CC(=O)CC(O)C(O)COS(=O)(=O)c1ccc(C)cc1

Molecular Processing

Molecular formula
C13H18O6S
Molecular weight
302.35
Exact mass
302.0824
XLogP
0.4
TPSA
100.9
H-bond donors
2
H-bond acceptors
6
Rotatable bonds
7
Heavy atoms
20
Rings
1
Aromatic rings
1
Saturated rings
0
Aliphatic rings
0
Stereo centers
2
Undefined stereo
2
Formal charge
0
Heteroatoms
7
Covalent units
1
Fraction Csp3
0.462
Molar refractivity
71.63

Supplementary Information

Fetching details…

Involved in 2 reactions→

Extended Search

Substructure Search→Similarity Search→