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
    3.0937    0.0012   -0.1811 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.9405   -0.3942   -0.6669 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.6775   -0.0677   -0.0341 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.5685    0.6546    1.0843 N   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7248    0.7322    1.3389 N   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4154    0.0891    0.4255 N   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5719   -0.4178   -0.4399 N   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8643    0.0102    0.4564 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.0433   -0.2279   -0.6317 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.0886    0.5946    0.7296 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.9307   -0.9806   -1.5651 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.3491    0.9418    0.1009 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.1691   -0.1281    1.5106 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.2482   -0.8074   -0.1875 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