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
    3.6169    0.8257    0.8324 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.1026   -0.0962    0.0361 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.6469   -0.2231   -0.1258 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.1788   -1.2080   -0.9735 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1588   -1.3985   -1.1845 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0467   -0.5641   -0.5149 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5376    0.4077    0.3233 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.7927    0.5791    0.5180 N   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3889    1.2678    1.0159 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7396    1.0872    0.8127 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.2686    0.1234   -0.0195 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4089   -0.7018   -0.6824 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.6851    0.9122    0.9456 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.9665    1.4772    1.3568 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.7776   -0.7529   -0.4918 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.8792   -1.8526   -1.4902 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5788   -2.1437   -1.8283 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9988    2.0340    1.6763 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.4561    1.7294    1.3269 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.3325   -0.0158   -0.1769 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7309   -1.4869   -1.3561 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