Cc1cccnc1C(=O)c1ccc(F)c([N+](=O)[O-])c1
Name: 2-(4-fluoro-5-nitrobenzoyl)-3-methylpyridine
SMILES: Cc1cccnc1C(=O)c1ccc(F)c([N+](=O)[O-])c1

Molecular Processing

Molecular formula
C13H9FN2O3
Molecular weight
260.22
Exact mass
260.0597
XLogP
2.67
TPSA
73.1
H-bond donors
0
H-bond acceptors
4
Rotatable bonds
3
Heavy atoms
19
Rings
2
Aromatic rings
2
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
6
Covalent units
1
Fraction Csp3
0.077
Molar refractivity
65.46

Supplementary Information

Details werden geladen…

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