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
    3.6589    0.9078   -0.2221 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.1155   -0.2811   -0.0589 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.6740   -0.4467   -0.0534 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.0888   -1.6751    0.1149 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2843   -1.7732    0.1117 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0974   -0.6646   -0.0571 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4568    0.5453   -0.2221 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.8850    0.6301   -0.2173 N   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2538    1.6552   -0.3909 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6323    1.5594   -0.3945 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.2717    0.3473   -0.2292 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4805   -0.7702   -0.0594 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.7323    1.0183   -0.2243 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.0394    1.7854   -0.3554 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.7338   -1.1513    0.0734 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.6801   -2.5833    0.2523 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7928   -2.7177    0.2404 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7644    2.6173   -0.5223 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.2557    2.4381   -0.5280 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.3590    0.2872   -0.2343 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.9592   -1.7283    0.0716 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