SMILES:
COC(=O)C(C)Oc1ccc(Oc2ccc(Cl)cc2F)cc1Molecular Processing
Molecular formula
C16H14ClFO4
Molecular weight
324.74
Exact mass
324.0565
XLogP
4.21
TPSA
44.76
H-bond donors
0
H-bond acceptors
4
Rotatable bonds
5
Heavy atoms
22
Rings
2
Aromatic rings
2
Saturated rings
0
Aliphatic rings
0
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
6
Covalent units
1
Fraction Csp3
0.188
Molar refractivity
80.03
Supplementary Information
Details werden geladen…
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