SMILES:
C#CC(C)(C)NCCC=OMolecular Processing
Molecular formula
C8H13NO
Molecular weight
139.2
Exact mass
139.0997
XLogP
0.58
TPSA
29.1
H-bond donors
1
H-bond acceptors
2
Rotatable bonds
4
Heavy atoms
10
Rings
0
Aromatic rings
0
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
2
Covalent units
1
Fraction Csp3
0.625
Molar refractivity
41.6
Supplementary Information
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