Name: 8-chloro-3-(chloromethyl)-2-(2-trifluoromethylphenyl)quinoline
SMILES:
FC(F)(F)c1ccccc1-c1nc2c(Cl)cccc2cc1CClMolecular Processing
Molecular formula
C17H10Cl2F3N
Molecular weight
356.17
Exact mass
355.0142
XLogP
6.31
TPSA
12.89
H-bond donors
0
H-bond acceptors
1
Rotatable bonds
2
Heavy atoms
23
Rings
3
Aromatic rings
3
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
6
Covalent units
1
Fraction Csp3
0.118
Molar refractivity
86.75
Supplementary Information
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