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
   -2.1807   -0.4140   -0.0392 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2814    0.4712   -0.3890 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.1004    0.2955   -0.0736 N   0  0  0  0  0  0  0  0  0  0  0  0
    1.1013    1.1394   -0.3844 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.2810    0.6469    0.0750 N   0  0  0  0  0  0  0  0  0  0  0  0
    2.0385   -0.5348    0.6929 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.6820   -0.7223    0.5832 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9573   -1.3253    0.5020 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.2143   -0.2546   -0.2906 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5963    1.3501   -0.9266 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.0466    2.0695   -0.9095 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.8019   -1.1304    1.1440 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.1784   -1.5912    0.9863 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