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
   -2.3833    0.1884   -1.5258 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0822    0.1842   -1.6202 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2152    0.1095   -0.4615 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.7938   -0.8734   -0.4236 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.6549   -0.9934    0.6398 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.6425   -1.9650    0.6632 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.5745   -0.1545    1.7279 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.6031    0.8083    1.7127 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2863    0.9426    0.6267 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2428    1.9406    0.6627 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.9329    0.1368   -0.6124 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.0070    0.2482   -2.4262 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6339    0.2383   -2.5971 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.8527   -1.5404   -1.2961 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.7865   -2.6298   -0.0838 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.2463   -0.2338    2.5801 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.4771    1.5136    2.5435 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8479    2.0798   -0.1099 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