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
    3.2590    0.3996    0.4956 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4527   -0.4675   -0.0817 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.0103   -0.3194   -0.0825 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.4379    0.7572    0.5355 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9624    0.8391    0.4970 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7201   -0.1198   -0.1331 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1257   -1.1732   -0.7356 N   0  0  0  0  0  0  0  0  0  0  0  0
    0.2263   -1.2853   -0.7186 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.2184   -0.0143   -0.1634 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.3415    0.2340    0.4631 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.9250    1.2792    1.0088 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.9087   -1.3306   -0.5772 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.9718    1.5435    1.0467 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4651    1.6908    0.9828 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.7414   -2.0990   -1.1805 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.6707   -0.8841    0.3730 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.5106    0.9178    0.3626 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.6014    0.0320   -1.1961 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