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
    2.7562   -0.4318   -0.4101 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.6911   -0.7977    0.2437 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.3934   -0.2080   -0.0090 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6708   -1.0733   -0.1152 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9664   -0.6038   -0.3446 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.9973   -1.5230   -0.4421 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1521    0.7523   -0.4621 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0739    1.5851   -0.3507 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.2368    1.1322   -0.1191 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2013    2.0894   -0.0254 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.6969    0.3353   -1.1756 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.7264   -0.8963   -0.1933 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.8087   -1.5817    1.0067 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5529   -2.1477   -0.0266 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8268   -2.5054   -0.3515 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.1598    1.1331   -0.6423 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2661    2.6571   -0.4507 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.1554    2.0842    0.1506 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