Monomers

1-Vinylimidazole

Identifiers

IUPAC name
1-ethenylimidazole
InchI
InChI=1S/C5H6N2/c1-2-7-4-3-6-5-7/h2-5H,1H2
InchI Key
OSSNTDFYBPYIEC-UHFFFAOYSA-N
SMILES
C=Cn1cncc1
Canonical SMILES
C=CN1C=CN=C1
Isomeric SMILES
C=CN1C=CN=C1
Resources
cid=

Structures

2D Structure
3D Structure

Molecular Formula and Computed Descriptors

Molecular Formula
C5H6N2
Heavy Atom Count
7
Molecular Weight
94.117
Exact Molecular Weight
94.0531
Valence Electrons
36
Radical Electrons
0
tPSA
17.82
MolLogP
0.9836
H Bond Acceptors
2
H Bond Donors
0
Aliphatic Carbocycles
0
Aromatic Carbocycles
0
Aliphatic Heterocycles
0
Aromatic Heterocycles
1
Aliphatic Rings
0
Aromatic Rings
1

MOL File


     RDKit          3D

 13 13  0  0  0  0  0  0  0  0999 V2000
   -2.0092   -0.9397   -0.3653 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3828    0.2213   -0.4538 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0168    0.3423   -0.2569 N   0  0  0  0  0  0  0  0  0  0  0  0
    0.7266    1.4773   -0.3286 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.0235    1.2221   -0.0872 N   0  0  0  0  0  0  0  0  0  0  0  0
    2.1398   -0.0975    0.1417 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.8768   -0.6444    0.0338 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.0718   -1.0460   -0.5126 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4172   -1.8138   -0.1345 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9971    1.0815   -0.6860 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.3420    2.4539   -0.5441 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.0864   -0.5614    0.3622 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.6662   -1.6956    0.1693 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  2  3
  2  3  1  0
  3  4  1  0
  4  5  2  0
  5  6  1  0
  6  7  2  0
  7  3  1  0
  1  8  1  0
  1  9  1  0
  2 10  1  0
  4 11  1  0
  6 12  1  0
  7 13  1  0
M  END

Similar Monomers

Structure
Similarity
IUPAC name
MF
Copolymers