C1=CC(=CC=C1CC2=NC=CN2)C#N
الاسم: 4-(1H-imidazol-2-ylmethyl)benzonitrile
SMILES: C1=CC(=CC=C1CC2=NC=CN2)C#N

Molecular Processing

Molecular formula
C11H9N3
Molecular weight
183.21
Exact mass
183.0796
XLogP
1.87
TPSA
52.47
H-bond donors
1
H-bond acceptors
2
Rotatable bonds
2
Heavy atoms
14
Rings
2
Aromatic rings
2
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
3
Covalent units
1
Fraction Csp3
0.091
Molar refractivity
52.55

Supplementary Information

InChIKey: ICGOVDHTTBNXJI-UHFFFAOYSA-N
مرادفات
SCHEMBL1507905ICGOVDHTTBNXJI-UHFFFAOYSA-N4-(1-imidazolylmethyl)benzonitrile4-[1-(imidazolyl)methyl]benzonitrile4-[1- (imidazolyl)methyl]benzonitrile
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