SMILES:
O=C(O)COc1ccc(Oc2ccc(C(F)(F)F)c(Cl)c2)cc1C(=O)[O-].O=C(O)COc1ccc(Oc2ccc(C(F)(F)F)c(Cl)c2)cc1C(=O)[O-].[NH4+].[NH4+]Molecular Processing
Molecular formula
C32H26Cl2F6N2O12
Molecular weight
815.46
Exact mass
814.0767
XLogP
6.71
TPSA
264.78
H-bond donors
4
H-bond acceptors
10
Rotatable bonds
12
Heavy atoms
54
Rings
4
Aromatic rings
4
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
22
Covalent units
4
Fraction Csp3
0.125
Molar refractivity
172.83
Supplementary Information
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