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
    3.9889   -0.3727   -0.3686 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.8552   -0.9854   -0.5506 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.5490   -0.4081   -0.2888 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.4652    0.8745    0.1857 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.2006    1.4053    0.4288 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9218    0.6583    0.1969 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8097   -0.6283   -0.2801 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.4214   -1.1212   -0.5080 N   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9527   -1.3743   -0.5109 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.1849   -0.8197   -0.2604 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.3142    0.4749    0.2202 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1679    1.2073    0.4459 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.9527   -0.8490   -0.5803 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.0708    0.6381   -0.0002 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.9232   -2.0213   -0.9339 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.3060    1.5138    0.3887 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.0973    2.4108    0.8022 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8579   -2.3870   -0.8867 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.1136   -1.3652   -0.4256 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.2826    0.9201    0.4206 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2250    2.2290    0.8236 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