COCC(C)NCCCS(=O)(=O)O
SMILES: COCC(C)NCCCS(=O)(=O)O

Molecular Processing

Molecular formula
C7H17NO4S
Molecular weight
211.28
Exact mass
211.0878
XLogP
-0.11
TPSA
75.63
H-bond donors
2
H-bond acceptors
4
Rotatable bonds
7
Heavy atoms
13
Rings
0
Aromatic rings
0
Saturated rings
0
Aliphatic rings
0
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
6
Covalent units
1
Fraction Csp3
1
Molar refractivity
50.37

Supplementary Information

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