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
   -3.0649   -0.1377    0.4471 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0953    0.1909   -0.3843 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7166    0.0124    0.0167 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2950   -0.4730    1.1956 N   0  0  0  0  0  0  0  0  0  0  0  0
    1.0249   -0.4876    1.1962 N   0  0  0  0  0  0  0  0  0  0  0  0
    1.4676   -0.0215    0.0415 N   0  0  0  0  0  0  0  0  0  0  0  0
    0.4138    0.2872   -0.6872 N   0  0  0  0  0  0  0  0  0  0  0  0
    2.8789    0.1187   -0.3397 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.1128   -0.0269    0.2033 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8336   -0.5382    1.4231 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3419    0.5905   -1.3577 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.1842    1.1700   -0.1873 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.0164   -0.0862   -1.4306 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.4742   -0.5985    0.2267 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