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
    2.9054   -0.0464   -0.0226 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.8783   -0.2341   -0.7876 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.5072   -0.0823   -0.3489 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5101   -0.7799   -1.0425 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7983   -0.6171   -0.6445 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8043   -1.3017   -1.3239 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1367    0.2109    0.4178 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1595    0.8941    1.0991 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.1816    0.7309    0.6919 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.1329    1.4410    1.4038 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.9178   -0.1835   -0.4448 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.8473    0.2164    0.9975 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.0319   -0.5297   -1.8508 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1780   -1.4031   -1.8538 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.1360   -2.2080   -1.0880 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.1648    0.3055    0.6927 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3903    1.5470    1.9312 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.8756    2.0400    2.1734 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