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
   -2.6750    0.0774   -0.8570 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2189    0.1999    0.3607 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7818    0.1235    0.5743 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1844    0.2327    1.7658 N   0  0  0  0  0  0  0  0  0  0  0  0
    1.1182    0.1134    1.5676 N   0  0  0  0  0  0  0  0  0  0  0  0
    1.3854   -0.0697    0.2854 N   0  0  0  0  0  0  0  0  0  0  0  0
    0.1983   -0.0621   -0.3247 N   0  0  0  0  0  0  0  0  0  0  0  0
    2.6978   -0.2426   -0.3263 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0082   -0.0749   -1.6736 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.7282    0.1310   -1.0325 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8859    0.3541    1.1914 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.6273    0.0106   -1.4223 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.3882    0.4793    0.1084 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.0672   -1.2728   -0.2171 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