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
    3.0796    0.0053    0.0248 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.0279   -0.4559   -0.6091 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.6824   -0.0896   -0.2454 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.3904    0.7487    0.7660 N   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8956    0.8832    0.8488 N   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4319    0.1390   -0.1000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4923   -0.4661   -0.7834 N   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8734    0.0219   -0.3364 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.9638    0.6936    0.8631 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.0830   -0.2683   -0.2469 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.1760   -1.1309   -1.4289 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.4370    0.3539    0.5361 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.1459   -1.0482   -0.5508 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.1271    0.6137   -1.2481 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