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
   -2.7131    0.7366   -0.4243 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1592   -0.4595   -0.2045 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7339   -0.6158    0.0107 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0800   -1.7631    0.2385 N   0  0  0  0  0  0  0  0  0  0  0  0
    1.2155   -1.5378    0.3900 N   0  0  0  0  0  0  0  0  0  0  0  0
    1.3731   -0.2363    0.2556 N   0  0  0  0  0  0  0  0  0  0  0  0
    0.2116    0.3459    0.0257 N   0  0  0  0  0  0  0  0  0  0  0  0
    2.6430    0.4445    0.3490 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.7698    0.8257   -0.5806 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0713    1.5835   -0.4374 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7985   -1.3317   -0.1880 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.4766   -0.2551    0.4549 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.8028    1.1239   -0.5365 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.6032    1.1392    1.2369 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