SMILES:
COC(=O)C=Cc1ccc(OC)cc1Molecular Processing
Molecular formula
C11H12O3
Molecular weight
192.21
Exact mass
192.0786
XLogP
1.88
TPSA
35.53
H-bond donors
0
H-bond acceptors
3
Rotatable bonds
3
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
0.182
Molar refractivity
54.04
Supplementary Information
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