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
   -4.0408   -0.0460   -0.1440 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.9619    0.7123   -0.2012 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5949    0.2304   -0.1309 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3111   -1.1058    0.0059 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0088   -1.5290    0.0693 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.0232   -0.6183   -0.0037 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.6832    0.7342   -0.1430 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5942    1.1370   -0.2040 N   0  0  0  0  0  0  0  0  0  0  0  0
    1.7368    1.6433   -0.2155 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.0441    1.2068   -0.1507 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.3722   -0.1055   -0.0155 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.3391   -1.0235    0.0582 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.9115   -1.1140   -0.0363 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.0450    0.3706   -0.2018 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.1555    1.7933   -0.3112 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0680   -1.8690    0.0689 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.2250   -2.5735    0.1765 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.4888    2.7024   -0.3243 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.8421    1.9500   -0.2111 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.4073   -0.4097    0.0317 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.5298   -2.0861    0.1664 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