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
    3.7627    0.3171    0.4521 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.0504   -0.7407    0.1578 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.6120   -0.6424    0.0310 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.8655   -1.7766   -0.2829 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5063   -1.6876   -0.4050 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1727   -0.4977   -0.2243 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4042    0.6059    0.0854 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.9325    0.5074    0.2018 N   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0715    1.8160    0.2701 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4411    1.9259    0.1527 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.2028    0.8196   -0.1569 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5460   -0.3783   -0.3402 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.2712    1.2614    0.5992 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.8362    0.3098    0.5605 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.5452   -1.6796    0.0121 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.4042   -2.7071   -0.4224 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1024   -2.5656   -0.6498 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4832    2.6732    0.5098 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.9709    2.8616    0.2941 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.2784    0.8685   -0.2570 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.1003   -1.2909   -0.5880 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