Monomers

2-Vinylquinoline

Identifiers

IUPAC name
2-ethenylquinoline
InchI
InChI=1S/C11H9N/c1-2-10-8-7-9-5-3-4-6-11(9)12-10/h2-8H,1H2
InchI Key
XUGNJOCQALIQFG-UHFFFAOYSA-N
SMILES
C=Cc1ccc2c(n1)cccc2
Canonical SMILES
C=CC1=NC2=CC=CC=C2C=C1
Isomeric SMILES
C=CC1=NC2=CC=CC=C2C=C1
Resources
cid=

Structures

2D Structure
3D Structure

Molecular Formula and Computed Descriptors

Molecular Formula
C11H9N
Heavy Atom Count
12
Molecular Weight
155.2
Exact Molecular Weight
155.0735
Valence Electrons
58
Radical Electrons
0
tPSA
12.89
MolLogP
2.8778
H Bond Acceptors
1
H Bond Donors
0
Aliphatic Carbocycles
0
Aromatic Carbocycles
1
Aliphatic Heterocycles
0
Aromatic Heterocycles
1
Aliphatic Rings
0
Aromatic Rings
2

MOL File


     RDKit          3D

 21 22  0  0  0  0  0  0  0  0999 V2000
    3.5694   -1.2217   -0.0196 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.1298    0.0149   -0.1724 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.6857    0.2848   -0.2110 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2110    1.5634   -0.3691 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1428    1.8187   -0.4055 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9972    0.7403   -0.2771 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5143   -0.5416   -0.1186 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.7979   -0.7482   -0.0883 N   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4235   -1.5692    0.0034 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7809   -1.3399   -0.0300 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.2529   -0.0426   -0.1903 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3572    0.9898   -0.3129 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.6339   -1.3917    0.0053 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.9162   -2.0703    0.0815 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.7806    0.8672   -0.2740 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.8989    2.4044   -0.4691 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5325    2.8408   -0.5319 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0957   -2.5919    0.1296 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.5105   -2.1508    0.0663 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.3098    0.1261   -0.2150 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7061    2.0172   -0.4398 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
  7  9  1  0
  9 10  2  0
 10 11  1  0
 11 12  2  0
  8  3  1  0
 12  6  1  0
  1 13  1  0
  1 14  1  0
  2 15  1  0
  4 16  1  0
  5 17  1  0
  9 18  1  0
 10 19  1  0
 11 20  1  0
 12 21  1  0
M  END

Similar Monomers

Structure
Similarity
IUPAC name
MF
Copolymers