이름: N-(4-fluoro-2-nitro-6-trifluoromethyl-phenyl)-acetamide
SMILES:
CC(=O)Nc1c([N+](=O)[O-])cc(F)cc1C(F)(F)FMolecular Processing
Molecular formula
C9H6F4N2O3
Molecular weight
266.15
Exact mass
266.0315
XLogP
2.71
TPSA
72.24
H-bond donors
1
H-bond acceptors
3
Rotatable bonds
2
Heavy atoms
18
Rings
1
Aromatic rings
1
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
9
Covalent units
1
Fraction Csp3
0.222
Molar refractivity
52.36
Supplementary Information
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