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
   -2.6813    0.5443   -0.2751 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1349   -0.6515   -0.1897 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6844   -0.7429   -0.0143 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0541   -1.8774    0.0933 N   0  0  0  0  0  0  0  0  0  0  0  0
    1.3333   -1.5038    0.2404 N   0  0  0  0  0  0  0  0  0  0  0  0
    1.4274   -0.2015    0.2298 N   0  0  0  0  0  0  0  0  0  0  0  0
    0.1920    0.2535    0.0740 N   0  0  0  0  0  0  0  0  0  0  0  0
    2.5717    0.6742    0.3522 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.7406    0.7082   -0.4049 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0806    1.4620   -0.2184 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7573   -1.5063   -0.2502 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.4561    1.3070    1.2590 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.5197    1.3832   -0.5109 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.5247    0.1511    0.2834 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