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
   -3.5241    1.3320   -0.1099 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.1053    0.0823   -0.0519 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6807   -0.2134    0.0003 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2575   -1.5475    0.0615 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0762   -1.8649    0.1118 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.9911   -0.8425    0.1008 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.5669    0.4928    0.0395 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7486    0.7558   -0.0083 N   0  0  0  0  0  0  0  0  0  0  0  0
    1.4824    1.5297    0.0280 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.8180    1.2680    0.0764 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.2348   -0.0473    0.1367 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.3421   -1.0812    0.1487 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8055    2.1383   -0.1186 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.5745    1.5813   -0.1495 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.8312   -0.7031   -0.0441 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0239   -2.3239    0.0678 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.3935   -2.8857    0.1584 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.1238    2.5470   -0.0197 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.5157    2.1012    0.0660 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.3124   -0.2226    0.1744 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.6944   -2.0964    0.1962 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