Название: 2-(acetylthiomethyl)-3-(acetylthio)propanoic acid
SMILES:
CC(=O)SCC(CSC(C)=O)C(=O)OMolecular Processing
Molecular formula
C8H12O4S2
Molecular weight
236.31
Exact mass
236.0177
XLogP
1.25
TPSA
71.44
H-bond donors
1
H-bond acceptors
5
Rotatable bonds
5
Heavy atoms
14
Rings
0
Aromatic rings
0
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
6
Covalent units
1
Fraction Csp3
0.625
Molar refractivity
57.4
Supplementary Information
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