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
   -2.9212   -0.4227    0.1069 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7879   -0.8978    0.5121 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5049   -0.3176    0.1582 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.6389   -1.1204    0.3157 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.8883   -0.6691    0.0303 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.9991   -1.5176    0.2070 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.1028    0.6070   -0.4317 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.9904    1.3974   -0.5878 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3022    0.9541   -0.3003 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3708    1.8111   -0.4808 O   0  0  0  0  0  0  0  0  0  0  0  0
   -3.0176    0.4289   -0.5187 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.8364   -0.9535    0.4462 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7664   -1.7945    1.1696 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.5344   -2.1347    0.6761 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.4689   -1.5149    1.1203 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.1009    0.9796   -0.6642 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.1168    2.4201   -0.9533 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3329    2.7446   -0.8055 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