Name: 2-chloro-2′-trifluoromethyl-5-methoxy-[1,1′-biphenyl]-4-carboxylic acid
SMILES:
COc1cc(-c2ccccc2C(F)(F)F)c(Cl)cc1C(=O)OMolecular Processing
Molecular formula
C15H10ClF3O3
Molecular weight
330.69
Exact mass
330.0271
XLogP
4.73
TPSA
46.53
H-bond donors
1
H-bond acceptors
2
Rotatable bonds
3
Heavy atoms
22
Rings
2
Aromatic rings
2
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
7
Covalent units
1
Fraction Csp3
0.133
Molar refractivity
75.4
Supplementary Information
Details werden geladen…
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