SMILES:
CCOC(=O)c1cc(Cl)oc1CMolecular Processing
Molecular formula
C8H9ClO3
Molecular weight
188.61
Exact mass
188.024
XLogP
2.42
TPSA
39.44
H-bond donors
0
H-bond acceptors
3
Rotatable bonds
2
Heavy atoms
12
Rings
1
Aromatic rings
1
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
4
Covalent units
1
Fraction Csp3
0.375
Molar refractivity
44.41
Supplementary Information
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