Name: methyl 5-methanesulfonyl-2-methyl-4-(3-pentafluorosulfanyl-phenoxy)benzoate
SMILES:
COC(=O)c1cc(S(C)(=O)=O)c(Oc2cccc(S(F)(F)(F)(F)F)c2)cc1CMolecular Processing
Molecular formula
C16H15F5O5S2
Molecular weight
446.42
Exact mass
446.0281
XLogP
5.63
TPSA
69.67
H-bond donors
0
H-bond acceptors
5
Rotatable bonds
5
Heavy atoms
28
Rings
2
Aromatic rings
2
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
12
Covalent units
1
Fraction Csp3
0.188
Molar refractivity
93.54
Supplementary Information
Details werden geladen…
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