SMILES:
O=Cc1ccc(OC2(C(=O)O)CCC2)c(Cl)c1ClMolecular Processing
Molecular formula
C12H10Cl2O4
Molecular weight
289.11
Exact mass
287.9956
XLogP
3.19
TPSA
63.6
H-bond donors
1
H-bond acceptors
3
Rotatable bonds
4
Heavy atoms
18
Rings
2
Aromatic rings
1
Saturated rings
1
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
6
Covalent units
1
Fraction Csp3
0.333
Molar refractivity
66.7
Supplementary Information
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