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
    3.6628    0.9599   -0.1133 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.0924   -0.2245   -0.0169 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.6432   -0.3691    0.0233 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.0904   -1.6467    0.1260 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2742   -1.8215    0.1666 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0771   -0.7082    0.1035 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5340    0.5718    0.0008 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.8100    0.6685   -0.0337 N   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3143    1.7048   -0.0641 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6819    1.5303   -0.0235 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.2206    0.2667    0.0779 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4447   -0.8701    0.1432 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.7315    1.0577   -0.1423 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.0160    1.8252   -0.1617 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.7311   -1.0923    0.0320 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.7848   -2.4816    0.1714 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7148   -2.7997    0.2455 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8596    2.6916   -0.1440 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.2875    2.4283   -0.0752 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.2861    0.1748    0.1064 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8674   -1.8659    0.2231 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