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
   -2.2999   -1.8314    0.0834 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9746   -0.5820    0.2761 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6209   -0.0854    0.0721 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.4216   -0.8843   -0.3375 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.7091   -0.3703   -0.5225 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.6830   -1.2600   -0.9359 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.9891    0.9588   -0.3025 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.9505    1.7655    0.1079 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3167    1.2651    0.2912 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3578    2.0789    0.7037 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6130   -2.5924   -0.2366 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.3378   -2.1195    0.2596 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7245    0.1307    0.6002 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.2401   -1.9486   -0.5235 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.2172   -1.7518   -0.2301 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.9988    1.3621   -0.4476 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.1914    2.8096    0.2759 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1558    3.0551    0.8661 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