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
   -2.2560    0.3320    0.2213 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2986   -0.2221   -0.4831 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0802   -0.0793   -0.1076 N   0  0  0  0  0  0  0  0  0  0  0  0
    0.5708    0.5941    0.9458 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.9305    0.4898    0.9540 N   0  0  0  0  0  0  0  0  0  0  0  0
    2.3038   -0.2549   -0.1015 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.1373   -0.6012   -0.7524 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.2867    0.2344   -0.0459 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9798    0.8966    1.0883 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5783   -0.7912   -1.3575 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0336    1.1307    1.6662 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.3319   -0.5236   -0.3758 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.0785   -1.2053   -1.6518 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