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
    3.7485   -0.8071   -0.3303 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.1318    0.1857    0.2723 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.6850    0.3318    0.2943 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.0556    1.3810    0.9323 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3166    1.5245    0.9563 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1180    0.5873    0.3194 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4742   -0.4555   -0.3137 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.8674   -0.5628   -0.3162 N   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2862   -1.3904   -0.9497 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6613   -1.2957   -0.9568 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.2913   -0.2451   -0.3180 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4987    0.6899    0.3170 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.8212   -0.8980   -0.3355 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.1666   -1.5656   -0.8424 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.7270    0.9261    0.7735 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.6815    2.1139    1.4303 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8087    2.3490    1.4578 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8177   -2.2079   -1.4478 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.2863   -2.0376   -1.4606 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.3725   -0.1534   -0.3128 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.9532    1.5299    0.8302 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