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
   -2.8172    0.0422   -0.0184 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8102   -0.6274    0.4865 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4465   -0.2224    0.1831 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.4497   -1.1787   -0.3322 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.7468   -0.8612   -0.6291 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.6537   -1.7775   -1.1369 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.1487    0.4382   -0.4043 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2845    1.3831    0.0996 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0529    1.0651    0.4094 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8847    2.0371    0.9198 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6508    0.8885   -0.6580 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.8508   -0.2136    0.1759 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0415   -1.4762    1.1249 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.0804   -2.1843   -0.4891 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.2553   -2.3604   -0.5870 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.1860    0.7187   -0.6356 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.5777    2.4158    0.2860 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8283    1.9131    1.2054 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