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
   -2.4915    1.2627    0.1676 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9812    0.0611    0.1621 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5513   -0.1287    0.0831 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.3100    0.9552    0.0117 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.6835    0.7839   -0.0643 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.5569    1.8555   -0.1361 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.1992   -0.4943   -0.0687 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.3349   -1.5640    0.0026 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0461   -1.4052    0.0793 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8049   -2.5673    0.1463 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9921    2.2011    0.1200 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.5925    1.3598    0.2294 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6279   -0.7972    0.2166 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0534    1.9842    0.0123 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.8300    2.2350   -1.0357 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.2741   -0.5963   -0.1288 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.7518   -2.5771   -0.0014 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7994   -2.5682    0.2039 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