Name: 1-cyanomethylimidazole
SMILES:
N#CCn1ccnc1Molecular Processing
Molecular formula
C5H5N3
Molecular weight
107.12
Exact mass
107.0483
XLogP
0.41
TPSA
41.61
H-bond donors
0
H-bond acceptors
2
Rotatable bonds
1
Heavy atoms
8
Rings
1
Aromatic rings
1
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
3
Covalent units
1
Fraction Csp3
0.2
Molar refractivity
27.84
Supplementary Information
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Involved in 4 reactions→