SMILES:
NC(C#CCO)C(=O)OMolecular Processing
Molecular formula
C5H7NO3
Molecular weight
129.11
Exact mass
129.0426
XLogP
-1.61
TPSA
83.55
H-bond donors
3
H-bond acceptors
3
Rotatable bonds
1
Heavy atoms
9
Rings
0
Aromatic rings
0
Saturated rings
0
Aliphatic rings
0
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
4
Covalent units
1
Fraction Csp3
0.4
Molar refractivity
30.47
Supplementary Information
Récupération des détails…
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