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
    2.3862   -1.2680    0.6795 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.9082   -0.4352   -0.2070 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.5224   -0.0121   -0.1435 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3486   -0.6071    0.7347 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6785   -0.1901    0.7966 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5716   -0.7847    1.6825 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0827    0.8214   -0.0388 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2049    1.4120   -0.9153 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.1250    1.0132   -0.9945 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.9984    1.6024   -1.8672 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.7970   -1.6598    1.4635 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.4353   -1.6016    0.6480 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.5668   -0.0656   -1.0005 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0811   -1.4140    1.4128 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.1039   -1.6032    1.3581 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.1148    1.1341    0.0196 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5085    2.2136   -1.5832 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.9555    1.4447   -2.0453 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