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
    2.7929    0.5387   -0.1053 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.1361   -0.5912   -0.2664 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.6876   -0.6631   -0.2036 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0722   -1.7510   -0.3520 N   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3550   -1.4590   -0.2348 N   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4093   -0.1618   -0.0079 N   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1706    0.3506    0.0162 N   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6201    0.6252    0.1910 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.8465    0.6216   -0.1457 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.2171    1.4344    0.0794 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.7192   -1.4740   -0.4493 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.4567   -0.0403    0.5060 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4330    1.4105    0.9636 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8825    1.1594   -0.7345 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