Nombre: MeCN DMSO
SMILES:
CC#N.CS(C)=OMolecular Processing
Molecular formula
C4H9NOS
Molecular weight
119.19
Exact mass
119.0405
XLogP
0.52
TPSA
40.86
H-bond donors
0
H-bond acceptors
2
Rotatable bonds
0
Heavy atoms
7
Rings
0
Aromatic rings
0
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
3
Covalent units
2
Fraction Csp3
0.75
Molar refractivity
31.28
Supplementary Information
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