N#CC1(Cc2ccc(Br)cc2I)CC1
Nombre: 1-(4-bromo-2-iodobenzyl)cyclopropanecarbonitrile
SMILES: N#CC1(Cc2ccc(Br)cc2I)CC1

Molecular Processing

Molecular formula
C11H9BrIN
Molecular weight
362.01
Exact mass
360.8963
XLogP
3.9
TPSA
23.79
H-bond donors
0
H-bond acceptors
1
Rotatable bonds
2
Heavy atoms
14
Rings
2
Aromatic rings
1
Saturated rings
1
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
3
Covalent units
1
Fraction Csp3
0.364
Molar refractivity
67.84

Supplementary Information

Obteniendo detalles…

Participa en 7 reacciones