SMILES:
CCNC[C@H]1COc2ccc(S(C)(=O)=O)cc2O1Molecular Processing
Molecular formula
C12H17NO4S
Molecular weight
271.34
Exact mass
271.0878
XLogP
0.84
TPSA
64.63
H-bond donors
1
H-bond acceptors
5
Rotatable bonds
4
Heavy atoms
18
Rings
2
Aromatic rings
1
Saturated rings
0
Aliphatic rings
1
Stereo centers
1
Undefined stereo
0
Formal charge
0
Heteroatoms
6
Covalent units
1
Fraction Csp3
0.5
Molar refractivity
68.01
Supplementary Information
Details werden geladen…
An 1 Reaktionen beteiligt→