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
    3.0080    2.2784   -0.4403 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.9037    0.9604   -0.3839 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.6545    0.2677   -0.1644 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.6592   -1.1103   -0.1236 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.4630   -1.7590    0.0862 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7104   -1.0558    0.2516 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6921    0.3217    0.2071 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.4804    0.9414    0.0020 N   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8741    1.0574    0.3729 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.0576    0.3935    0.5811 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.1053   -0.9685    0.6298 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9306   -1.6784    0.4644 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.1445    2.9188   -0.3224 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.9581    2.7636   -0.6061 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.8017    0.3802   -0.5092 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.5798   -1.6904   -0.2524 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.4460   -2.8480    0.1218 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7860    2.1299    0.3265 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.9840    0.9565    0.7114 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.0473   -1.4882    0.7953 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9117   -2.7711    0.4944 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