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
    2.3654    1.7145   -0.5990 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.9473    0.4750   -0.6305 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.6008    0.0702   -0.2494 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3505    0.9665    0.1789 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6101    0.5111    0.5251 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5803    1.4150    0.9605 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9733   -0.8062    0.4652 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0158   -1.6993    0.0353 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.2496   -1.2815   -0.3178 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.1745   -2.2059   -0.7414 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.7240    2.4994   -0.2859 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.3706    1.9427   -0.8934 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.6332   -0.3347   -0.9613 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1201    2.0414    0.2491 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.1636    1.8153    0.2393 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.9628   -1.1773    0.7353 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3064   -2.7588   -0.0134 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.0175   -3.1874   -0.8228 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