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
    2.4827   -1.2870    0.4328 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.0025   -0.1978   -0.1038 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.5739    0.0760   -0.0632 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3513   -0.7560    0.5202 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7144   -0.5117    0.5683 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5662   -1.4185    1.1831 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1901    0.6461   -0.0070 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2983    1.5079   -0.6024 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0776    1.2496   -0.6444 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.8778    2.1835   -1.2673 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.8829   -2.0096    0.9120 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.5692   -1.4744    0.3903 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.7072    0.4791   -0.5719 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0247   -1.6858    0.9896 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.9670   -2.1555    0.6408 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.2483    0.8629    0.0153 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6737    2.4163   -1.0534 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.8603    2.0749   -1.3392 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