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
    3.0591   -0.0959   -0.5484 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.9720   -0.7713   -0.2653 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.6545   -0.1156   -0.1422 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.4570    1.2123   -0.3071 N   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8351    1.3976   -0.1180 N   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4080    0.2394    0.1508 N   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5165   -0.7076    0.1425 N   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8468    0.1168    0.4105 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.9992    0.9637   -0.6964 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.0108   -0.5842   -0.6351 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.9945   -1.8317   -0.1110 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.3736    0.8545   -0.1994 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.0533    0.2391    1.4866 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.1138   -0.9172    0.1083 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