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
   -2.6921    0.6987    0.0039 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1661   -0.5041   -0.1281 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7138   -0.6982   -0.2102 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0258   -1.8323   -0.3432 N   0  0  0  0  0  0  0  0  0  0  0  0
    1.2556   -1.5039   -0.3705 N   0  0  0  0  0  0  0  0  0  0  0  0
    1.3618   -0.1912   -0.2566 N   0  0  0  0  0  0  0  0  0  0  0  0
    0.1724    0.3049   -0.1589 N   0  0  0  0  0  0  0  0  0  0  0  0
    2.6207    0.5473   -0.2458 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.7586    0.8446    0.0645 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0669    1.5770    0.0554 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7914   -1.3819   -0.1795 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.0768    0.3636    0.7438 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.4669    1.6185   -0.4640 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.2606    0.1568   -1.0869 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