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
   -3.1255   -0.0439    0.1270 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0426    0.6731    0.2220 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6983    0.0633    0.1092 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4206   -1.2347   -0.0941 N   0  0  0  0  0  0  0  0  0  0  0  0
    0.9106   -1.3990   -0.1383 N   0  0  0  0  0  0  0  0  0  0  0  0
    1.4671   -0.2121    0.0362 N   0  0  0  0  0  0  0  0  0  0  0  0
    0.4932    0.6782    0.1868 N   0  0  0  0  0  0  0  0  0  0  0  0
    2.8935    0.0548    0.0569 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.0930    0.4257    0.2128 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.0124   -1.1146   -0.0393 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1337    1.7399    0.3874 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.0824    1.1165    0.3145 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.3385   -0.1330   -0.9466 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.3407   -0.6142    0.8273 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