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
   -2.1147   -0.0308   -0.6370 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1517   -0.8233   -0.1922 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.1485   -0.3313    0.1087 N   0  0  0  0  0  0  0  0  0  0  0  0
    1.2003   -1.0332    0.5630 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.2416   -0.1952    0.7188 N   0  0  0  0  0  0  0  0  0  0  0  0
    1.8919    1.0559    0.3726 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.5602    0.9511   -0.0121 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8850    1.0001   -0.7649 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.0994   -0.3594   -0.8733 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3919   -1.8576   -0.0669 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.1571   -2.1127    0.7569 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.4919    1.9558    0.3825 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0487    1.7807   -0.3562 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