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
   -3.0786    0.2847   -0.3647 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0614   -0.5226   -0.1208 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6979   -0.0435   -0.3091 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3307    1.1756   -0.7196 N   0  0  0  0  0  0  0  0  0  0  0  0
    0.9747    1.2399   -0.7698 N   0  0  0  0  0  0  0  0  0  0  0  0
    1.4690    0.0756   -0.3965 N   0  0  0  0  0  0  0  0  0  0  0  0
    0.4488   -0.7168   -0.1124 N   0  0  0  0  0  0  0  0  0  0  0  0
    2.8989   -0.2567   -0.3186 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.9364    1.3123   -0.7070 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.1048   -0.0204   -0.2412 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2915   -1.5219    0.2142 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.1866   -0.1077    0.7401 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.0390   -1.3118   -0.6546 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.4843    0.4132   -0.9706 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