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
    3.4818   -1.3895   -0.3059 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.0779   -0.1768   -0.5834 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.6645    0.1440   -0.4463 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2245    1.4173   -0.7351 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1032    1.7744   -0.6221 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9815    0.7950   -0.2040 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5350   -0.4929    0.0879 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.7564   -0.7486   -0.0479 N   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4242   -1.4609    0.5046 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7391   -1.1086    0.6168 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.2204    0.1591    0.3363 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3147    1.1234   -0.0820 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.7881   -2.1363    0.0168 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.5176   -1.6384   -0.4025 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.7720    0.5678   -0.9056 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.9566    2.1706   -1.0658 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4591    2.7710   -0.8463 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1092   -2.4766    0.7408 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.4542   -1.8660    0.9460 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.2516    0.4411    0.4227 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6471    2.1309   -0.3131 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