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
    2.5017   -1.4369   -0.4221 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.9430   -0.3604    0.0951 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.5591   -0.0073   -0.0505 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3259   -0.7930   -0.7668 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6634   -0.4463   -0.9042 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4766   -1.2880   -1.6362 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0962    0.7122   -0.3039 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2417    1.5063    0.4096 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.1021    1.1653    0.5521 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.9049    2.0187    1.2887 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.5705   -1.6612   -0.2798 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.9278   -2.1200   -0.9940 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.6324    0.2688    0.6641 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.0246   -1.7213   -1.2468 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.4495   -1.1464   -1.8042 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.1576    0.9934   -0.4092 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6335    2.4206    0.8702 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.8785    1.8953    1.4681 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