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
   -2.8004   -0.5086   -0.2305 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7037   -0.9552    0.3546 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4225   -0.3182    0.1422 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.7089   -1.0858   -0.1845 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.9481   -0.5297   -0.3821 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.0582   -1.3106   -0.7058 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.0650    0.8357   -0.2503 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.9881    1.6263    0.0685 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2717    1.0321    0.2672 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2987    1.8508    0.5873 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8238    0.3404   -0.8951 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.7709   -0.9811   -0.0740 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8134   -1.8371    1.0124 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.5967   -2.1475   -0.2825 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.6646   -1.7091    0.0037 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.0523    1.2768   -0.4089 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.0654    2.6983    0.1750 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2422    1.7224    0.8028 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