O=C(O)C(Cc1ccccc1)(c1cccc(OC(F)(F)F)c1)c1cccc(OC(F)(F)F)c1
Name: 3-phenyl-2,2-bis(3-(trifluoromethoxy)phenyl)propanoic acid
SMILES: O=C(O)C(Cc1ccccc1)(c1cccc(OC(F)(F)F)c1)c1cccc(OC(F)(F)F)c1

Molecular Processing

Molecular formula
C23H16F6O4
Molecular weight
470.37
Exact mass
470.0953
XLogP
6.1
TPSA
55.76
H-bond donors
1
H-bond acceptors
3
Rotatable bonds
7
Heavy atoms
33
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
0.174
Molar refractivity
104.81

Supplementary Information

Details werden geladen…

An 3 Reaktionen beteiligt