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
   -2.0223   -0.8079   -0.1022 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3559    0.2714   -0.4761 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0346    0.3277   -0.1556 N   0  0  0  0  0  0  0  0  0  0  0  0
    0.8944    1.3341   -0.4445 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.1239    1.0401    0.0112 N   0  0  0  0  0  0  0  0  0  0  0  0
    2.0793   -0.1657    0.6045 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.7694   -0.5943    0.4909 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5482   -1.6204    0.4240 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.0950   -0.8445   -0.3529 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8111    1.0886   -0.9998 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.6083    2.2448   -0.9728 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.8983   -0.7160    1.0858 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.4242   -1.5578    0.8873 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