SMILES:
O=C(Cl)C1(c2ccc3c(c2)OCO3)CC1Molecular Processing
Molecular formula
C11H9ClO3
Molecular weight
224.64
Exact mass
224.024
XLogP
2.21
TPSA
35.53
H-bond donors
0
H-bond acceptors
3
Rotatable bonds
2
Heavy atoms
15
Rings
3
Aromatic rings
1
Saturated rings
1
Aliphatic rings
2
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
4
Covalent units
1
Fraction Csp3
0.364
Molar refractivity
54.34
Supplementary Information
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