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
    2.7507    0.6274    0.4854 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.1063   -0.4897    0.7303 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.6652   -0.6116    0.4340 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1045   -1.6896    0.6355 N   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3459   -1.3738    0.2308 N   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3647   -0.1285   -0.2159 N   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1442    0.3246   -0.0892 N   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5662    0.5119   -0.7265 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.7813    0.7095    0.6991 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.2356    1.4739    0.0633 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.6312   -1.3278    1.1517 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.1498   -0.2527   -1.2878 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.2282    0.8552    0.1020 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2668    1.3713   -1.3580 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