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
   -1.8997    0.8269   -0.7115 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3178   -0.3259   -0.5149 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0303   -0.3484    0.0033 N   0  0  0  0  0  0  0  0  0  0  0  0
    0.7442   -1.4619    0.2515 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.9580   -1.0974    0.7275 N   0  0  0  0  0  0  0  0  0  0  0  0
    2.0366    0.2459    0.7898 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.8015    0.6960    0.3251 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3848    1.7338   -0.4918 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8961    0.8543   -1.0943 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8380   -1.2461   -0.7370 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.3914   -2.4781    0.0915 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.8600    0.8638    1.1214 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.5143    1.7371    0.2394 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