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
   -2.6214    0.5095    0.6973 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1609   -0.4877   -0.0329 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7412   -0.6135   -0.2540 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0549   -1.5384   -0.9558 N   0  0  0  0  0  0  0  0  0  0  0  0
    1.2307   -1.2462   -0.8765 N   0  0  0  0  0  0  0  0  0  0  0  0
    1.3861   -0.1769   -0.1552 N   0  0  0  0  0  0  0  0  0  0  0  0
    0.1946    0.2185    0.2299 N   0  0  0  0  0  0  0  0  0  0  0  0
    2.6051    0.5348    0.2192 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.6792    0.6351    0.8841 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9494    1.2233    1.1250 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8869   -1.2032   -0.4566 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.4312   -0.2064    0.2873 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.4764    1.0363    1.2003 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.7695    1.3147   -0.5328 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