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
   -3.1355   -0.0803   -0.1045 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0503    0.1088    0.5935 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7060   -0.0131    0.0271 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3872   -0.3259   -1.2480 N   0  0  0  0  0  0  0  0  0  0  0  0
    0.9487   -0.3336   -1.3550 N   0  0  0  0  0  0  0  0  0  0  0  0
    1.4716   -0.0351   -0.1853 N   0  0  0  0  0  0  0  0  0  0  0  0
    0.4699    0.1600    0.6557 N   0  0  0  0  0  0  0  0  0  0  0  0
    2.8918    0.0719    0.1634 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.0618   -0.3376   -1.1425 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.1039    0.0159    0.3369 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1418    0.3673    1.6371 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.4069    0.5844   -0.6962 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.3641   -0.9191    0.2783 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.0334    0.7364    1.0396 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