CC(C)C(C(=O)O)c1ccc(Cl)cc1
SMILES: CC(C)C(C(=O)O)c1ccc(Cl)cc1

Molecular Processing

Molecular formula
C11H13ClO2
Molecular weight
212.68
Exact mass
212.0604
XLogP
3.16
TPSA
37.3
H-bond donors
1
H-bond acceptors
1
Rotatable bonds
3
Heavy atoms
14
Rings
1
Aromatic rings
1
Saturated rings
0
Aliphatic rings
0
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
3
Covalent units
1
Fraction Csp3
0.364
Molar refractivity
56.67

Supplementary Information

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