C[N+]([O-])=C(Cn1ccnc1)c1ccc(Cl)cc1
名称: 1-(4-chlorophenyl)-2-(1H-imidazol-1-yl)-N-methylethanimine N-oxide
SMILES: C[N+]([O-])=C(Cn1ccnc1)c1ccc(Cl)cc1

Molecular Processing

Molecular formula
C12H12ClN3O
Molecular weight
249.7
Exact mass
249.0669
XLogP
2.17
TPSA
43.89
H-bond donors
0
H-bond acceptors
2
Rotatable bonds
3
Heavy atoms
17
Rings
2
Aromatic rings
2
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
5
Covalent units
1
Fraction Csp3
0.167
Molar refractivity
67.34

Supplementary Information

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