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
    2.1537    1.7995   -2.8828 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.7925    0.6558   -2.3729 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.9229    0.5068   -1.2270 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.4161    1.6049   -0.5957 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4180    1.4128    0.5050 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7234    0.1474    0.9449 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1956   -0.9660    0.2866 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.5996   -0.7388   -0.7641 N   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4880   -2.2498    0.7101 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3093   -2.4754    1.7951 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8251   -1.3735    2.4379 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5379   -0.0957    2.0215 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.8376    2.7523   -2.4978 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.8269    1.7921   -3.7660 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.1683   -0.2728   -2.8368 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.6571    2.5932   -0.9426 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8209    2.2758    1.0070 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0759   -3.1136    0.1960 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5548   -3.4730    2.1482 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4691   -1.5461    3.2885 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9568    0.7642    2.5447 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