SMILES:
CCCC=CC(=O)OMolecular Processing
Molecular formula
C6H10O2
Molecular weight
114.14
Exact mass
114.0681
XLogP
1.43
TPSA
37.3
H-bond donors
1
H-bond acceptors
1
Rotatable bonds
3
Heavy atoms
8
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
0.5
Molar refractivity
31.68
Supplementary Information
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