Cn1nc(C(F)(F)F)cc1Oc1cc(Oc2cc(C(F)(F)F)nn2C)nc(Oc2cc(C(F)(F)F)nn2C)c1
名称: 2,4,6-tris-(1-methyl-3-trifluoromethylpyrazol-5-yloxy)pyridine
SMILES: Cn1nc(C(F)(F)F)cc1Oc1cc(Oc2cc(C(F)(F)F)nn2C)nc(Oc2cc(C(F)(F)F)nn2C)c1

Molecular Processing

Molecular formula
C20H14F9N7O3
Molecular weight
571.36
Exact mass
571.1014
XLogP
5.72
TPSA
94.04
H-bond donors
0
H-bond acceptors
7
Rotatable bonds
6
Heavy atoms
39
Rings
4
Aromatic rings
4
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
19
Covalent units
1
Fraction Csp3
0.3
Molar refractivity
109.09

Supplementary Information

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