Name: ethyl 4-methyl-2-thioxopyrrolidine-3-carboxylate
SMILES:
CCOC(=O)C1C(=S)NCC1CMolecular Processing
Molecular formula
C8H13NO2S
Molecular weight
187.26
Exact mass
187.0667
XLogP
0.73
TPSA
38.33
H-bond donors
1
H-bond acceptors
3
Rotatable bonds
2
Heavy atoms
12
Rings
1
Aromatic rings
0
Saturated rings
1
Aliphatic rings
1
Stereo centers
2
Undefined stereo
2
Formal charge
0
Heteroatoms
4
Covalent units
1
Fraction Csp3
0.75
Molar refractivity
49.89
Supplementary Information
Details werden geladen…
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