Name: N-(3-Chlorobenzyl)-5-fluoro-2-nitrobenzenamine
SMILES:
O=[N+]([O-])c1ccc(F)cc1NCc1cccc(Cl)c1Molecular Processing
Molecular formula
C13H10ClFN2O2
Molecular weight
280.69
Exact mass
280.0415
XLogP
4
TPSA
55.17
H-bond donors
1
H-bond acceptors
3
Rotatable bonds
4
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
71.83
Supplementary Information
Details werden geladen…
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