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
    3.1043   -0.0260   -0.3603 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.9991   -0.7202   -0.4245 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.6945   -0.1193   -0.1533 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.4843    1.1639    0.1801 N   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8202    1.3309    0.3453 N   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4542    0.1907    0.1273 N   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5220   -0.6875   -0.1761 N   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8931    0.0603    0.2326 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.0605   -0.4832   -0.5631 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.1056    1.0215   -0.1045 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.0417   -1.7784   -0.6871 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.3809    1.0176    0.0393 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.2668   -0.7456   -0.4406 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.1529   -0.2247    1.2876 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