SMILES:
O=Cc1ccc(C(=O)O)c(F)c1Molecular Processing
Molecular formula
C8H5FO3
Molecular weight
168.12
Exact mass
168.0223
XLogP
1.34
TPSA
54.37
H-bond donors
1
H-bond acceptors
2
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
Molar refractivity
38.75
Supplementary Information
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