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
   -2.9993    0.0081   -0.1019 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9320   -0.7300    0.0044 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5615   -0.3058    0.1078 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.4161   -1.2915    0.2541 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.7537   -0.9778    0.3587 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.6850   -1.9752    0.5014 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.1498    0.3487    0.3186 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2230    1.3471    0.1762 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1345    0.9911    0.0723 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0709    2.0076   -0.0723 O   0  0  0  0  0  0  0  0  0  0  0  0
   -3.0220    1.0647   -0.1291 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.9902   -0.4784   -0.1724 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1569   -1.8305    0.0114 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.0983   -2.3342    0.2852 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.6721   -1.8417    0.5842 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.2043    0.6177    0.3998 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.4727    2.4073    0.1381 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8078    2.9728   -0.1039 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