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
    2.5385   -0.5415    0.7220 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.1667   -0.3316   -0.5175 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.7864   -0.0562   -0.8239 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.1758    0.1876   -1.9971 N   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1134    0.3803   -1.7346 N   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3468    0.2700   -0.4508 N   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1797    0.0028    0.1003 N   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5872    0.3986    0.2851 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.8092   -0.5061    1.4989 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.5727   -0.7531    0.9965 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.8865   -0.3606   -1.3337 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.3854   -0.0232   -0.3841 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5133   -0.1418    1.2388 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8100    1.4747    0.5338 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