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
    3.6244   -0.8678   -0.9021 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.1188    0.2414   -0.4149 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.6898    0.3909   -0.1296 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.1737    1.5633    0.3823 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1767    1.6828    0.6439 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0599    0.6407    0.4053 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5085   -0.5166   -0.1068 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.8181   -0.6095   -0.3548 N   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3750   -1.5653   -0.3505 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7261   -1.4570   -0.0929 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.2771   -0.3005    0.4188 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4093    0.7445    0.6609 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.6725   -0.9764   -1.1110 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.9647   -1.6846   -1.0944 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.7895    1.0651   -0.2218 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.8339    2.3919    0.5788 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6215    2.5876    1.0465 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9584   -2.4712   -0.7490 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.4088   -2.2979   -0.2903 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.3429   -0.2224    0.6193 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8213    1.6608    1.0625 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