SMILES:
CC(=O)c1ccc(OC2CCCCO2)cc1FMolecular Processing
Molecular formula
C13H15FO3
Molecular weight
238.26
Exact mass
238.1005
XLogP
2.93
TPSA
35.53
H-bond donors
0
H-bond acceptors
3
Rotatable bonds
3
Heavy atoms
17
Rings
2
Aromatic rings
1
Saturated rings
1
Aliphatic rings
1
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
4
Covalent units
1
Fraction Csp3
0.462
Molar refractivity
60.62
Supplementary Information
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