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
   -2.2492   -1.8653    0.4172 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9267   -0.7012   -0.0915 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6062   -0.1011   -0.0486 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.4397   -0.7496    0.5586 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.7224   -0.1815    0.6079 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.7690   -0.8770    1.2393 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.9508    1.0435    0.0434 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.8970    1.6908   -0.5652 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3705    1.1542   -0.6266 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4369    1.8037   -1.2397 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5180   -2.4519    0.9098 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.2482   -2.2858    0.3677 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7508   -0.1576   -0.5867 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.3329   -1.7362    1.0336 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.2927   -1.4972    0.6120 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.9324    1.5256    0.0570 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.0188    2.6680   -1.0315 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2492    2.7185   -1.6567 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