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
   -3.5568    1.1239    0.1944 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.0600   -0.0856    0.2458 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6428   -0.3707    0.0833 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1170   -1.6384    0.1366 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.2335   -1.8550   -0.0236 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.0651   -0.7766   -0.2407 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.5244    0.4817   -0.2910 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7969    0.6479   -0.1298 N   0  0  0  0  0  0  0  0  0  0  0  0
    1.2830    1.6154   -0.5037 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.6431    1.4607   -0.6713 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.2067    0.2030   -0.6241 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4243   -0.9131   -0.4099 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.9218    1.9643    0.0269 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.6054    1.2766    0.3203 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.7078   -0.9556    0.4179 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7763   -2.4760    0.3070 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.6649   -2.8501    0.0157 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.8033    2.5876   -0.5343 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.2239    2.3685   -0.8380 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.2747    0.1117   -0.7586 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.8380   -1.9203   -0.3671 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