Name: 66.41D
SMILES:
C=CC(C)(C)C(O)c1cc(C(=O)OC)ccc1-c1cc(OC)ccc1FMolecular Processing
Molecular formula
C21H23FO4
Molecular weight
358.41
Exact mass
358.158
XLogP
4.53
TPSA
55.76
H-bond donors
1
H-bond acceptors
4
Rotatable bonds
6
Heavy atoms
26
Rings
2
Aromatic rings
2
Saturated rings
0
Aliphatic rings
0
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
5
Covalent units
1
Fraction Csp3
0.286
Molar refractivity
98.67
Supplementary Information
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