C=CCC1CN(C(=O)OC(C)(C)C)CC1=O
Name: tert-butyl 3-allyl-4-oxopyrrolidine-1-carboxylate
SMILES: C=CCC1CN(C(=O)OC(C)(C)C)CC1=O

Molecular Processing

Molecular formula
C12H19NO3
Molecular weight
225.29
Exact mass
225.1365
XLogP
2
TPSA
46.61
H-bond donors
0
H-bond acceptors
3
Rotatable bonds
2
Heavy atoms
16
Rings
1
Aromatic rings
0
Saturated rings
1
Aliphatic rings
1
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
4
Covalent units
1
Fraction Csp3
0.667
Molar refractivity
61.12

Supplementary Information

Details werden geladen…

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