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
    2.5515   -1.2007    0.8195 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.8426   -0.0967    0.9225 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.5158    0.0587    0.3396 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1280   -0.9238   -0.3729 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4005   -0.7289   -0.9134 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0258   -1.7414   -1.6290 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0355    0.4801   -0.7316 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4194    1.4893   -0.0219 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1666    1.2558    0.4934 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.4448    2.2864    1.2096 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.2076   -2.0900    0.2909 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.5354   -1.3070    1.2554 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.2974    0.7251    1.4777 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.3606   -1.8631   -0.5164 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6219   -2.6319   -1.7939 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.0403    0.6672   -1.1450 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9278    2.4564    0.1233 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.0103    3.1646    1.3546 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