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
   -3.1146   -0.0187    0.0480 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9998   -0.7033   -0.0617 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6854   -0.0605   -0.0534 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4091    1.2491    0.0599 N   0  0  0  0  0  0  0  0  0  0  0  0
    0.8958    1.4469    0.0263 N   0  0  0  0  0  0  0  0  0  0  0  0
    1.4486    0.2588   -0.1087 N   0  0  0  0  0  0  0  0  0  0  0  0
    0.5086   -0.6639   -0.1587 N   0  0  0  0  0  0  0  0  0  0  0  0
    2.8735   -0.0038   -0.1909 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.1001    1.0519    0.1491 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.0604   -0.5233    0.0380 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0577   -1.7775   -0.1614 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.4404    0.9110   -0.0082 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.1384   -0.3969   -1.2126 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.1218   -0.7700    0.5589 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