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
   -2.7629    0.3347    0.5235 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1060   -0.7783    0.2598 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6699   -0.7270    0.0107 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.1260   -1.7832   -0.2702 N   0  0  0  0  0  0  0  0  0  0  0  0
    1.3718   -1.3176   -0.4308 N   0  0  0  0  0  0  0  0  0  0  0  0
    1.3902   -0.0101   -0.2618 N   0  0  0  0  0  0  0  0  0  0  0  0
    0.1443    0.3405    0.0064 N   0  0  0  0  0  0  0  0  0  0  0  0
    2.5727    0.8468   -0.3595 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.8298    0.3462    0.7152 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2299    1.2838    0.5536 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6693   -1.6959    0.2393 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.8810    0.8967   -1.4021 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.4195    0.4242    0.2483 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.3624    1.8391    0.0992 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