Monomers

2-Methyl-5-vinylpyridine

Identifiers

IUPAC name
5-ethenyl-2-methylpyridine
InchI
InChI=1S/C8H9N/c1-3-8-5-4-7(2)9-6-8/h3-6H,1H2,2H3
InchI Key
VJOWMORERYNYON-UHFFFAOYSA-N
SMILES
C=Cc1ccc(nc1)C
Canonical SMILES
CC1=NC=C(C=C1)C=C
Isomeric SMILES
CC1=NC=C(C=C1)C=C
Resources
cid=

Structures

2D Structure
3D Structure

Molecular Formula and Computed Descriptors

Molecular Formula
C8H9N
Heavy Atom Count
9
Molecular Weight
119.167
Exact Molecular Weight
119.0735
Valence Electrons
46
Radical Electrons
0
tPSA
12.89
MolLogP
2.033
H Bond Acceptors
1
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

 18 18  0  0  0  0  0  0  0  0999 V2000
   -2.9309   -0.8504   -1.2708 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3782   -0.8023   -0.0891 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0110   -0.3479    0.0642 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2339    0.0488   -0.9946 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.0622    0.4651   -0.7307 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.5725    0.4864    0.5530 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.7620    0.0843    1.5605 N   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4891   -0.3231    1.3520 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.9572    0.9272    0.8682 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4157   -0.5661   -2.1477 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.9488   -1.1924   -1.3538 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.9226   -1.1000    0.8152 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5980    0.0433   -1.9909 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.7047    0.7855   -1.5427 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0708   -0.6278    2.2087 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.0063    1.5887    1.7365 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.3683    1.3877   -0.0632 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.5660   -0.0069    1.0252 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  2  3
  2  3  1  0
  3  4  2  0
  4  5  1  0
  5  6  2  0
  6  7  1  0
  7  8  2  0
  6  9  1  0
  8  3  1  0
  1 10  1  0
  1 11  1  0
  2 12  1  0
  4 13  1  0
  5 14  1  0
  8 15  1  0
  9 16  1  0
  9 17  1  0
  9 18  1  0
M  END

Similar Monomers

Structure
Similarity
IUPAC name
MF
Copolymers