SMILES:
OCc1cc(F)c2c(c1)OCCO2Molecular Processing
Molecular formula
C9H9FO3
Molecular weight
184.17
Exact mass
184.0536
XLogP
1.09
TPSA
38.69
H-bond donors
1
H-bond acceptors
3
Rotatable bonds
1
Heavy atoms
13
Rings
2
Aromatic rings
1
Saturated rings
0
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
4
Covalent units
1
Fraction Csp3
0.333
Molar refractivity
43.31
Supplementary Information
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