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
    3.3318    0.2930    0.1723 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4003   -0.5661    0.5000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.9779   -0.3443    0.2184 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.5008    0.7805   -0.4117 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8716    0.8841   -0.6271 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7678   -0.0820   -0.2405 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2782   -1.1729    0.3738 N   0  0  0  0  0  0  0  0  0  0  0  0
    0.0537   -1.2987    0.5957 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.2328    0.0995   -0.5066 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.3560    0.0724    0.4060 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.1030    1.2109   -0.3229 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.7018   -1.4893    1.0065 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.1794    1.5625   -0.7302 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2055    1.7743   -1.1207 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.4450   -2.1920    1.0977 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.5723    1.1099   -0.1895 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.3677    0.0481   -1.5934 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.7536   -0.6898    0.0601 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