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
    4.0123   -0.0521   -0.0948 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.9468   -0.7994   -0.1105 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.6106   -0.2680   -0.0311 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.3371    1.0826    0.0691 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0281    1.5629    0.1441 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0221    0.6725    0.1181 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7255   -0.6698    0.0178 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.5346   -1.0849   -0.0513 N   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7420   -1.6217   -0.0134 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.0373   -1.1744    0.0589 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.3842    0.1488    0.1596 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3376    1.0677    0.1876 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.0165    1.0272   -0.0222 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.0192   -0.4854   -0.1568 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.0755   -1.8748   -0.1872 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.1446    1.8035    0.0915 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1650    2.6193    0.2217 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4658   -2.6586   -0.0925 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.8496   -1.8951    0.0367 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.4262    0.4905    0.2166 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5700    2.1091    0.2655 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