SMILES:
O=C(Oc1ccccc1)OC(Cl)c1ccccc1Molecular Processing
Molecular formula
C14H11ClO3
Molecular weight
262.69
Exact mass
262.0397
XLogP
4.14
TPSA
35.53
H-bond donors
0
H-bond acceptors
3
Rotatable bonds
3
Heavy atoms
18
Rings
2
Aromatic rings
2
Saturated rings
0
Aliphatic rings
0
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
4
Covalent units
1
Fraction Csp3
0.071
Molar refractivity
68.59
Supplementary Information
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