SMILES:
COC(=O)c1ccc(CCCO)cc1Molecular Processing
Molecular formula
C11H14O3
Molecular weight
194.23
Exact mass
194.0943
XLogP
1.4
TPSA
46.53
H-bond donors
1
H-bond acceptors
3
Rotatable bonds
4
Heavy atoms
14
Rings
1
Aromatic rings
1
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
3
Covalent units
1
Fraction Csp3
0.364
Molar refractivity
53.19
Supplementary Information
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