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
   -3.1214    0.1184    0.2876 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0106   -0.4004    0.7782 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6999   -0.0349    0.2549 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4692    0.8480   -0.7600 N   0  0  0  0  0  0  0  0  0  0  0  0
    0.8505    0.9220   -0.9553 N   0  0  0  0  0  0  0  0  0  0  0  0
    1.4579    0.1153   -0.0974 N   0  0  0  0  0  0  0  0  0  0  0  0
    0.5079   -0.4550    0.6262 N   0  0  0  0  0  0  0  0  0  0  0  0
    2.8903   -0.1024    0.0265 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.0831   -0.1646    0.6883 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.1212    0.8350   -0.5203 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0445   -1.1147    1.5864 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.1269   -0.4790    1.0640 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.4695    0.8282   -0.0847 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.2470   -0.9161   -0.6502 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