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
    3.8852   -0.4920   -0.8100 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.6417   -0.7310   -1.1588 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.4680   -0.3208   -0.3896 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.5453    0.3707    0.8007 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.4233    0.7584    1.5282 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8035    0.4254    1.0166 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8916   -0.2641   -0.1696 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.2231   -0.6106   -0.8258 N   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1371   -0.5920   -0.6715 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.2412   -0.2114    0.0428 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.1785    0.4769    1.2283 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9205    0.8087    1.7364 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.6979   -0.8286   -1.4333 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.0862    0.0401    0.0988 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.4531   -1.2774   -2.0929 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.5239    0.6342    1.2052 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.5430    1.3000    2.4574 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2342   -1.1338   -1.6024 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.2116   -0.4721   -0.3572 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.0535    0.7755    1.7894 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8189    1.3439    2.6555 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