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
   -2.9474    0.7956   -0.8134 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9660   -0.0012   -1.1419 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6519    0.1356   -0.4683 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3197    1.0206    0.4881 N   0  0  0  0  0  0  0  0  0  0  0  0
    0.9483    0.8100    0.8212 N   0  0  0  0  0  0  0  0  0  0  0  0
    1.4039   -0.1813    0.0944 N   0  0  0  0  0  0  0  0  0  0  0  0
    0.4433   -0.6073   -0.6992 N   0  0  0  0  0  0  0  0  0  0  0  0
    2.7425   -0.7542    0.1220 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7963    1.5385   -0.0634 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.8910    0.6945   -1.2997 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1103   -0.7508   -1.8953 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.7817   -1.4044    1.0238 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.9186   -1.3916   -0.7548 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.4442    0.0961    0.2012 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