Name: 3-fluoro-4-(trifluoromethyl)benzaldehyde
SMILES:
O=Cc1ccc(C(F)(F)F)c(F)c1Molecular Processing
Molecular formula
C8H4F4O
Molecular weight
192.11
Exact mass
192.0198
XLogP
2.66
TPSA
17.07
H-bond donors
0
H-bond acceptors
1
Rotatable bonds
1
Heavy atoms
13
Rings
1
Aromatic rings
1
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
5
Covalent units
1
Fraction Csp3
0.125
Molar refractivity
36.79
Supplementary Information
Details werden geladen…
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