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
   -3.2097   -0.0890    0.8247 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4874   -0.5234   -0.1569 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0529   -0.2898   -0.2008 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3549    0.3923    0.7665 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.0295    0.5947    0.6841 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.7120    0.0959   -0.3978 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.0293   -0.5763   -1.3526 N   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2912   -0.7666   -1.2691 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.1757    0.3237   -0.4607 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7747    0.4534    1.6312 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.2703   -0.2694    0.8438 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.9923   -1.0771   -0.9611 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8496    0.7947    1.6216 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.5850    1.1275    1.4363 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8478   -1.3056   -2.0319 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.3717    1.3184   -0.0183 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.6591   -0.4407    0.2089 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.5686    0.2373   -1.4974 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