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
   -2.6706    1.2985    0.2705 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0657    0.1915   -0.1042 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6212    0.0124   -0.0488 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.2495    0.9867    0.4019 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.6207    0.7720    0.4372 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4680    1.7757    0.8972 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.0747   -0.4510    0.0049 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2228   -1.4362   -0.4483 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1343   -1.2275   -0.4848 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0135   -2.1983   -0.9348 O   0  0  0  0  0  0  0  0  0  0  0  0
   -3.7612    1.3706    0.2043 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0804    2.1192    0.6377 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7067   -0.6260   -0.4745 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1372    1.9395    0.7358 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.4577    1.6032    0.9160 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.1366   -0.6412    0.0230 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.5889   -2.4069   -0.7910 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6280   -3.0822   -1.2423 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