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
   -2.6198   -0.9200    0.6933 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1661    0.3004    0.5770 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7805    0.5571    0.2080 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1949    1.7733    0.0563 N   0  0  0  0  0  0  0  0  0  0  0  0
    1.0594    1.5908   -0.2794 N   0  0  0  0  0  0  0  0  0  0  0  0
    1.3278    0.2909   -0.3561 N   0  0  0  0  0  0  0  0  0  0  0  0
    0.2023   -0.3205   -0.0580 N   0  0  0  0  0  0  0  0  0  0  0  0
    2.6253   -0.2532   -0.7048 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9637   -1.7511    0.5148 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.6382   -1.1130    0.9645 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8426    1.1159    0.7609 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.7841   -0.2984   -1.8051 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.4555    0.3277   -0.2286 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.7515   -1.2998   -0.3428 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