N#CCC=NNc1c(Cl)cc(C(F)(F)F)cc1Cl
名称: 3-(2,6-dichloro-4-trifluoromethylphenylhydrazono)propionitrile
SMILES: N#CCC=NNc1c(Cl)cc(C(F)(F)F)cc1Cl

Molecular Processing

Molecular formula
C10H6Cl2F3N3
Molecular weight
296.08
Exact mass
294.9891
XLogP
4.32
TPSA
48.18
H-bond donors
1
H-bond acceptors
3
Rotatable bonds
3
Heavy atoms
18
Rings
1
Aromatic rings
1
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
8
Covalent units
1
Fraction Csp3
0.2
Molar refractivity
63.81

Supplementary Information

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