Nom: (2S)-3-[(6-chloronaphthalen-2-yl)sulfonyl]-2-hydroxypropionic acid
SMILES:
O=C(O)[C@H](O)CS(=O)(=O)c1ccc2cc(Cl)ccc2c1Molecular Processing
Molecular formula
C13H11ClO5S
Molecular weight
314.75
Exact mass
314.0016
XLogP
1.71
TPSA
91.67
H-bond donors
2
H-bond acceptors
4
Rotatable bonds
4
Heavy atoms
20
Rings
2
Aromatic rings
2
Saturated rings
0
Aliphatic rings
0
Stereo centers
1
Undefined stereo
0
Formal charge
0
Heteroatoms
7
Covalent units
1
Fraction Csp3
0.154
Molar refractivity
74.65
Supplementary Information
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