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
   -4.0056   -0.2116    0.2612 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.9021   -0.9073    0.3621 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5911   -0.3546    0.1658 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4340    0.9707   -0.1462 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1464    1.4515   -0.3248 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.9622    0.6637   -0.2032 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.7670   -0.6625    0.1111 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4729   -1.1342    0.2850 N   0  0  0  0  0  0  0  0  0  0  0  0
    1.8875   -1.4694    0.2365 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.1685   -1.0002    0.0609 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.3436    0.3222   -0.2515 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.2481    1.1453   -0.3819 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.9974   -0.6910    0.4238 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.0222    0.8414    0.0208 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.9815   -1.9724    0.6104 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2739    1.6757   -0.2632 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0087    2.4937   -0.5710 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.7294   -2.4967    0.4803 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.0578   -1.6072    0.1527 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.3280    0.7355   -0.3985 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.3435    2.2075   -0.6303 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