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
    3.0906   -0.1466   -0.0921 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.9956   -0.7134    0.3752 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.6881   -0.1348    0.0884 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.4896    0.9754   -0.6430 N   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8143    1.1770   -0.6764 N   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4392    0.2336    0.0073 N   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5206   -0.5728    0.4778 N   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8844    0.1682    0.1646 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.0662   -0.5589    0.1089 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.0391    0.7432   -0.6867 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.0274   -1.6086    0.9750 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.3090   -0.4461   -0.6442 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.1283   -0.3080    1.1208 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.3007    1.1918    0.1902 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