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
   -2.7932    0.3377    0.0092 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0912   -0.7550   -0.1891 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6291   -0.7024   -0.0656 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.2050   -1.7404   -0.2411 N   0  0  0  0  0  0  0  0  0  0  0  0
    1.4124   -1.3027   -0.0483 N   0  0  0  0  0  0  0  0  0  0  0  0
    1.3745   -0.0222    0.2438 N   0  0  0  0  0  0  0  0  0  0  0  0
    0.1241    0.3577    0.2360 N   0  0  0  0  0  0  0  0  0  0  0  0
    2.5710    0.7844    0.5208 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.8618    0.3520   -0.0690 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3106    1.2715    0.2611 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5686   -1.6718   -0.4367 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.2963    1.5502    1.2884 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.4131    0.1653    0.8437 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.8583    1.3757   -0.3901 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