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
   -2.4299    1.4124    0.0865 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9003    0.3353   -0.4530 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5356   -0.0455   -0.1812 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.2846    0.7143    0.6686 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.6011    0.3433    0.9283 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.3996    1.0839    1.7563 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.0730   -0.7949    0.3236 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2979   -1.5670   -0.5171 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0309   -1.1796   -0.7702 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7693   -1.9546   -1.5985 O   0  0  0  0  0  0  0  0  0  0  0  0
   -3.4818    1.6961   -0.1299 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9402    2.1020    0.7576 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5303   -0.2372   -1.0980 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0957    1.5909    1.1278 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.9978    1.8596    1.4347 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.1081   -1.0895    0.5258 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.6642   -2.4633   -0.9954 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7122   -1.8061   -1.8658 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