이름: 2-(trifluoromethyl)nicotinamide
SMILES:
NC(=O)c1cccnc1C(F)(F)FMolecular Processing
Molecular formula
C7H5F3N2O
Molecular weight
190.12
Exact mass
190.0354
XLogP
1.2
TPSA
55.98
H-bond donors
1
H-bond acceptors
2
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
6
Covalent units
1
Fraction Csp3
0.143
Molar refractivity
37.76
Supplementary Information
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