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
    3.2844    0.2815   -0.9434 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4480   -0.4883   -0.3037 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.0280   -0.2230   -0.1155 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.2212   -1.1172    0.5882 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1222   -0.8560    0.7603 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7153    0.2806    0.2530 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9295    1.1327   -0.4217 N   0  0  0  0  0  0  0  0  0  0  0  0
    0.4046    0.8946   -0.6048 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.1797    0.5508    0.4489 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.9522    1.1940   -1.3851 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.3143    0.0047   -1.0317 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.8578   -1.4224    0.1318 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.7006   -2.0100    0.9835 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7483   -1.5423    1.3021 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.0159    1.6045   -1.1565 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.6717   -0.4530    0.3824 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.4876    1.2307   -0.3546 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.3726    0.9380    1.4666 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