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
    2.6907   -0.7202    0.2070 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.6918   -0.7643   -0.6426 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.4209   -0.1986   -0.3077 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7076   -0.9359   -0.5654 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9853   -0.4764   -0.2924 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.1131   -1.2416   -0.5624 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0479    0.7861    0.2622 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9645    1.5670    0.5406 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.3159    1.0489    0.2406 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.3612    1.8879    0.5373 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.6892   -0.2909    1.1893 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.6758   -1.1591   -0.0601 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.8373   -1.2296   -1.5931 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6435   -1.9298   -1.0028 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.4475   -1.8638    0.1787 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.0458    1.1589    0.4823 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0543    2.5581    0.9783 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.3268    1.8031    0.4101 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