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
    3.2562    0.8339    0.3878 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4744   -0.2012    0.3065 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.0286   -0.0955    0.2322 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.2590   -1.2671    0.1465 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0950   -1.1562    0.0773 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7216    0.0720    0.0895 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9529    1.1472    0.1716 N   0  0  0  0  0  0  0  0  0  0  0  0
    0.3992    1.1289    0.2441 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.1977    0.1192    0.0114 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.9354    1.8609    0.4092 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.3439    0.6821    0.4410 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.9234   -1.2039    0.2930 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.7826   -2.2313    0.1386 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6686   -2.0819    0.0115 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.9590    2.0573    0.3093 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.5645    0.2244    1.0655 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.5681    0.9394   -0.6353 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.5934   -0.8280   -0.4176 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