SMILES:
COC=CCCC(=O)OCMolecular Processing
Molecular formula
C7H12O3
Molecular weight
144.17
Exact mass
144.0786
XLogP
1.1
TPSA
35.53
H-bond donors
0
H-bond acceptors
3
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
3
Covalent units
1
Fraction Csp3
0.571
Molar refractivity
37.4
Supplementary Information
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