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
   -3.1000   -0.3101   -0.0783 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0869    0.4658   -0.4051 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7058    0.0590   -0.1945 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3428   -1.1175    0.3402 N   0  0  0  0  0  0  0  0  0  0  0  0
    0.9772   -1.1552    0.3840 N   0  0  0  0  0  0  0  0  0  0  0  0
    1.4505   -0.0173   -0.1162 N   0  0  0  0  0  0  0  0  0  0  0  0
    0.4277    0.7088   -0.4626 N   0  0  0  0  0  0  0  0  0  0  0  0
    2.8812    0.2425   -0.2034 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8815   -1.2712    0.3568 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.1051    0.0362   -0.2540 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2586    1.4477   -0.8486 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.1092    0.9416   -1.0176 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.4583   -0.7092   -0.3135 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.1766    0.6789    0.7787 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