이름: 5-bromo-2-butyl-1-(2-methylpropyl)-1H-imidazole-4-carbonitrile
SMILES:
CCCCc1nc(C#N)c(Br)n1CC(C)CMolecular Processing
Molecular formula
C12H18BrN3
Molecular weight
284.2
Exact mass
283.0684
XLogP
3.52
TPSA
41.61
H-bond donors
0
H-bond acceptors
2
Rotatable bonds
5
Heavy atoms
16
Rings
1
Aromatic rings
1
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
4
Covalent units
1
Fraction Csp3
0.667
Molar refractivity
68.09
Supplementary Information
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