Name: [4-iodo-3,5-bis-(2,2,2-trifluoro-ethoxy)-phenyl]-acetic acid ethyl ester
SMILES:
CCOC(=O)Cc1cc(OCC(F)(F)F)c(I)c(OCC(F)(F)F)c1Molecular Processing
Molecular formula
C14H13F6IO4
Molecular weight
486.15
Exact mass
485.9763
XLogP
4.28
TPSA
44.76
H-bond donors
0
H-bond acceptors
4
Rotatable bonds
7
Heavy atoms
25
Rings
1
Aromatic rings
1
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
11
Covalent units
1
Fraction Csp3
0.5
Molar refractivity
82.6
Supplementary Information
Details werden geladen…
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