SMILES:
COC(=O)N=C=SMolecular Processing
Molecular formula
C3H3NO2S
Molecular weight
117.13
Exact mass
116.9884
XLogP
0.86
TPSA
38.66
H-bond donors
0
H-bond acceptors
3
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
4
Covalent units
1
Fraction Csp3
0.333
Molar refractivity
27.43
Supplementary Information
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