Nombre: 2-amino-6-chloro-5-(3,5-dichlorophenyl)benzonitrile
SMILES:
N#Cc1c(N)ccc(-c2cc(Cl)cc(Cl)c2)c1ClMolecular Processing
Molecular formula
C13H7Cl3N2
Molecular weight
297.57
Exact mass
295.9675
XLogP
4.77
TPSA
49.81
H-bond donors
1
H-bond acceptors
2
Rotatable bonds
1
Heavy atoms
18
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
Molar refractivity
76.04
Supplementary Information
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