이름: 2-n-butyl-4,5-dicyanoimidazole
SMILES:
CCCCc1nc(C#N)c(C#N)[nH]1Molecular Processing
Molecular formula
C9H10N4
Molecular weight
174.21
Exact mass
174.0905
XLogP
1.5
TPSA
76.26
H-bond donors
1
H-bond acceptors
3
Rotatable bonds
3
Heavy atoms
13
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
0.444
Molar refractivity
46.63
Supplementary Information
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