Monomers

2-Methyl-5-vinyltetrazole

Identifiers

IUPAC name
5-ethenyl-2-methyltetrazole
InchI
InChI=1S/C4H6N4/c1-3-4-5-7-8(2)6-4/h3H,1H2,2H3
InchI Key
BHRMHWAEINWAJS-UHFFFAOYSA-N
SMILES
C=Cc1nnn(n1)C
Canonical SMILES
CN1N=C(N=N1)C=C
Isomeric SMILES
CN1N=C(N=N1)C=C
Resources
cid=

Structures

2D Structure
3D Structure

Molecular Formula and Computed Descriptors

Molecular Formula
C4H6N4
Heavy Atom Count
8
Molecular Weight
110.12
Exact Molecular Weight
110.0592
Valence Electrons
42
Radical Electrons
0
tPSA
43.6
MolLogP
-0.1469
H Bond Acceptors
4
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

 14 14  0  0  0  0  0  0  0  0999 V2000
   -2.7901   -0.5511   -0.6446 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1764    0.4047    0.0241 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7272    0.5334    0.0761 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0090    1.4572    0.7183 N   0  0  0  0  0  0  0  0  0  0  0  0
    1.3032    1.2070    0.5029 N   0  0  0  0  0  0  0  0  0  0  0  0
    1.4071    0.1364   -0.2680 N   0  0  0  0  0  0  0  0  0  0  0  0
    0.1833   -0.2713   -0.5264 N   0  0  0  0  0  0  0  0  0  0  0  0
    2.6772   -0.4195   -0.7019 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.8458   -0.6439   -0.6818 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1915   -1.2725   -1.1787 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7738    1.1215    0.5549 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.1685   -0.9881    0.1281 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.3109    0.4265   -1.0594 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.4456   -1.1402   -1.5103 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  1  0
  6  8  1  0
  7  3  2  0
  1  9  1  0
  1 10  1  0
  2 11  1  0
  8 12  1  0
  8 13  1  0
  8 14  1  0
M  END

Similar Monomers

Structure
Similarity
IUPAC name
MF
Copolymers