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
   -2.7765    0.4841    0.2063 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1181   -0.6573    0.2830 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6680   -0.7018    0.1448 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.1375   -1.7754    0.1985 N   0  0  0  0  0  0  0  0  0  0  0  0
    1.4031   -1.4356    0.0308 N   0  0  0  0  0  0  0  0  0  0  0  0
    1.4101   -0.1245   -0.1329 N   0  0  0  0  0  0  0  0  0  0  0  0
    0.1683    0.3295   -0.0663 N   0  0  0  0  0  0  0  0  0  0  0  0
    2.5916    0.7213   -0.3552 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2110    1.3887    0.0378 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.8301    0.5434    0.3033 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6833   -1.5583    0.4511 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.3584    1.3771   -1.2270 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.4794    0.1033   -0.5262 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.7386    1.3056    0.5774 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