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
   -2.0780    0.6928   -0.4040 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3792   -0.3483    0.0095 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0366   -0.3300    0.1163 N   0  0  0  0  0  0  0  0  0  0  0  0
    0.8186   -1.3430    0.5267 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.1248   -0.9642    0.5009 N   0  0  0  0  0  0  0  0  0  0  0  0
    2.1775    0.3044    0.0693 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.8826    0.6877   -0.1658 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.1546    0.6471   -0.4742 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6210    1.6331   -0.6906 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9235   -1.2403    0.2725 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.4419   -2.3107    0.8291 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.0666    0.8904   -0.0610 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.6075    1.6808   -0.5289 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