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
    2.7500   -0.7803   -0.0077 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.9565    0.1994   -0.3617 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.4976    0.1826   -0.1934 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1037   -0.9391    0.3784 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4609   -0.9596    0.5372 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0687   -2.0795    1.1089 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2602    0.0884    0.1529 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6959    1.1929   -0.4072 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3087    1.2329   -0.5780 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.2171    2.3585   -1.1432 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.8148   -0.6654   -0.1768 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.4405   -1.6939    0.4380 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.3773    1.1083   -0.8176 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.4854   -1.7722    0.6890 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1653   -2.0507    2.1204 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.3554    0.0355    0.2973 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2970    2.0198   -0.7136 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.1767    2.5226   -1.3229 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