Name: tert-butyl 2-(2-oxopyridin-1(2H)-yl)propanoate
SMILES:
CC(C(=O)OC(C)(C)C)n1ccccc1=OMolecular Processing
Molecular formula
C12H17NO3
Molecular weight
223.27
Exact mass
223.1208
XLogP
1.75
TPSA
48.3
H-bond donors
0
H-bond acceptors
3
Rotatable bonds
2
Heavy atoms
16
Rings
1
Aromatic rings
1
Saturated rings
0
Aliphatic rings
0
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
4
Covalent units
1
Fraction Csp3
0.5
Molar refractivity
61.26
Supplementary Information
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