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
   -3.0916   -0.0724   -0.0825 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0211   -0.1753    0.6694 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7042   -0.0351    0.0909 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4201    0.2052   -1.2174 N   0  0  0  0  0  0  0  0  0  0  0  0
    0.8924    0.2705   -1.3743 N   0  0  0  0  0  0  0  0  0  0  0  0
    1.4635    0.0780   -0.1975 N   0  0  0  0  0  0  0  0  0  0  0  0
    0.5040   -0.1053    0.6809 N   0  0  0  0  0  0  0  0  0  0  0  0
    2.9083    0.0713    0.0730 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.0333    0.1206   -1.1605 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.1014   -0.1689    0.2990 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1252   -0.3639    1.7157 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.4421    0.1236   -0.8824 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.1292    0.9096    0.7586 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.1575   -0.8579    0.6269 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