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
   -2.4593   -1.3059    0.1002 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2318   -0.0298    0.2638 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8596    0.4525    0.1714 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4780    1.7198    0.3152 N   0  0  0  0  0  0  0  0  0  0  0  0
    0.8420    1.7438    0.1604 N   0  0  0  0  0  0  0  0  0  0  0  0
    1.3129    0.5390   -0.0763 N   0  0  0  0  0  0  0  0  0  0  0  0
    0.2443   -0.2666   -0.0687 N   0  0  0  0  0  0  0  0  0  0  0  0
    2.6766    0.1104   -0.3041 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.4603   -1.6781    0.1646 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6592   -1.9850   -0.0974 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.0660    0.6518    0.4659 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.7211   -0.7791   -0.9781 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.1734   -0.1057    0.6596 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.2439    0.9328   -0.7764 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