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
   -2.1394   -0.5404    0.1250 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3106    0.4683   -0.0941 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0919    0.3387   -0.0727 N   0  0  0  0  0  0  0  0  0  0  0  0
    0.9680    1.3273   -0.2877 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.2055    0.8035   -0.1814 N   0  0  0  0  0  0  0  0  0  0  0  0
    2.1134   -0.5097    0.0993 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.7660   -0.8008    0.1675 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7461   -1.5205    0.3325 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.2062   -0.4053    0.1009 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7321    1.4559   -0.3031 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.7462    2.3829   -0.5120 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.9012   -1.2251    0.2485 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.3423   -1.7747    0.3773 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