SMILES:
C#CC(=O)OCC=C(C)CMolecular Processing
Molecular formula
C8H10O2
Molecular weight
138.17
Exact mass
138.0681
XLogP
1.13
TPSA
26.3
H-bond donors
0
H-bond acceptors
2
Rotatable bonds
2
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
0.375
Molar refractivity
39.22
Supplementary Information
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