Monomers

2-Vinylhydroquinone

Identifiers

IUPAC name
2-ethenylbenzene-1,4-diol
InchI
InChI=1S/C8H8O2/c1-2-6-5-7(9)3-4-8(6)10/h2-5,9-10H,1H2
InchI Key
GWYFZTJDIQALEB-UHFFFAOYSA-N
SMILES
C=Cc1cc(O)ccc1O
Canonical SMILES
C=CC1=C(C=CC(=C1)O)O
Isomeric SMILES
C=CC1=C(C=CC(=C1)O)O
Resources
cid=

Structures

2D Structure
3D Structure

Molecular Formula and Computed Descriptors

Molecular Formula
C8H8O2
Heavy Atom Count
10
Molecular Weight
136.15
Exact Molecular Weight
136.0524
Valence Electrons
52
Radical Electrons
0
tPSA
40.46
MolLogP
1.7408
H Bond Acceptors
2
H Bond Donors
2
Aliphatic Carbocycles
0
Aromatic Carbocycles
1
Aliphatic Heterocycles
0
Aromatic Heterocycles
0
Aliphatic Rings
0
Aromatic Rings
1

MOL File


     RDKit          3D

 18 18  0  0  0  0  0  0  0  0999 V2000
    2.3494   -1.5135    0.5608 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.9571   -0.4132   -0.0338 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.5605   -0.0405   -0.0557 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4440   -0.7917    0.5307 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7827   -0.3874    0.4819 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7768   -1.1524    1.0750 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0458    0.7899   -0.1762 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0673    1.5515   -0.7651 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.2481    1.1554   -0.7178 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2718    1.8881   -1.2961 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.4267   -1.7934    0.5732 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.6322   -2.1489    1.0382 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.7109    0.2211   -0.5157 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2186   -1.7167    1.0451 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5931   -2.0119    1.5567 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.0685    1.1301   -0.2320 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3112    2.4908   -1.2854 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.1513    2.7425   -1.7837 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  1  0
  5  7  2  0
  7  8  1  0
  8  9  2  0
  9 10  1  0
  9  3  1  0
  1 11  1  0
  1 12  1  0
  2 13  1  0
  4 14  1  0
  6 15  1  0
  7 16  1  0
  8 17  1  0
 10 18  1  0
M  END

Similar Monomers

Structure
Similarity
IUPAC name
MF
Copolymers