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
   -2.4466    1.3718   -0.0657 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1467    0.1965   -0.5408 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8243   -0.4084   -0.4356 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3841   -1.5819   -0.8677 N   0  0  0  0  0  0  0  0  0  0  0  0
    0.8950   -1.6781   -0.5310 N   0  0  0  0  0  0  0  0  0  0  0  0
    1.2892   -0.6042    0.1031 N   0  0  0  0  0  0  0  0  0  0  0  0
    0.2308    0.1876    0.1667 N   0  0  0  0  0  0  0  0  0  0  0  0
    2.6071   -0.2837    0.6516 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7228    1.9785    0.4426 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.4431    1.7390   -0.1876 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8987   -0.3832   -1.0446 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.0527    0.5203    0.0332 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.2588   -1.1664    0.5966 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.5327    0.1120    1.6791 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