Name: 2-nitro-1-(2,5-difluorophenyl)ethanone
SMILES:
O=C(C[N+](=O)[O-])c1cc(F)ccc1FMolecular Processing
Molecular formula
C8H5F2NO3
Molecular weight
201.13
Exact mass
201.0237
XLogP
1.42
TPSA
60.21
H-bond donors
0
H-bond acceptors
3
Rotatable bonds
3
Heavy atoms
14
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
0.125
Molar refractivity
42.55
Supplementary Information
Details werden geladen…
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