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
    2.6759    0.9742    0.4346 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.2323   -0.2588    0.2435 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.7954   -0.5514    0.1739 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.2332   -1.7537   -0.0151 N   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0778   -1.6294   -0.0204 N   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3786   -0.3610    0.1628 N   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2345    0.3067    0.2828 N   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7144    0.2415    0.2281 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.9949    1.8208    0.5480 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.7426    1.1371    0.4782 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.9297   -1.0774    0.1346 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8998    0.9021   -0.6490 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8420    0.8540    1.1231 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.4568   -0.6048    0.1766 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