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
    2.6348    1.0559   -0.1941 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.2450   -0.1918   -0.0711 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.8309   -0.5316    0.0087 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.3054   -1.7692    0.1355 N   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0113   -1.6533    0.1720 N   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3572   -0.3822    0.0730 N   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2363    0.2877   -0.0253 N   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7185    0.1203    0.0773 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.8828    1.8269   -0.2350 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.6717    1.3272   -0.2546 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.0066   -0.9524   -0.0315 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.9918    0.6045   -0.8836 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8421    0.9329    0.8517 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.4201   -0.6748    0.3770 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