Name: (4′-{1-ethyl-1-[3-methyl-4-((E)-4,4,4-trifluoro-3-hydroxy-3-trifluoromethyl-1-butenyl)-phenyl]-propyl}-3-fluoro-2′-methyl-biphenyl-4-yl)acetic acid methyl ester
SMILES:
CCC(CC)(c1ccc(/C=C/C(O)(C(F)(F)F)C(F)(F)F)c(C)c1)c1ccc(-c2ccc(CC(=O)OC)c(F)c2)c(C)c1Molecular Processing
Molecular formula
C33H33F7O3
Molecular weight
610.61
Exact mass
610.2318
XLogP
8.8
TPSA
46.53
H-bond donors
1
H-bond acceptors
3
Rotatable bonds
9
Heavy atoms
43
Rings
3
Aromatic rings
3
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
10
Covalent units
1
Fraction Csp3
0.364
Molar refractivity
150.93
Supplementary Information
Details werden geladen…
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