Monomers

2-(4-Ethenylphenyl)propan-1-ol

Identifiers

IUPAC name
2-(4-ethenylphenyl)propan-1-ol
InchI
InChI=1S/C11H14O/c1-3-10-4-6-11(7-5-10)9(2)8-12/h3-7,9,12H,1,8H2,2H3
InchI Key
IWONVDRULKJRQP-UHFFFAOYSA-N
SMILES
OCC(c1ccc(cc1)C=C)C
Canonical SMILES
CC(CO)C1=CC=C(C=C1)C=C
Isomeric SMILES
CC(CO)C1=CC=C(C=C1)C=C
Resources
cid=

Structures

2D Structure
3D Structure

Molecular Formula and Computed Descriptors

Molecular Formula
C11H14O
Heavy Atom Count
12
Molecular Weight
162.232
Exact Molecular Weight
162.1045
Valence Electrons
64
Radical Electrons
0
tPSA
20.23
MolLogP
2.4254
H Bond Acceptors
1
H Bond Donors
1
Aliphatic Carbocycles
0
Aromatic Carbocycles
1
Aliphatic Heterocycles
0
Aromatic Heterocycles
0
Aliphatic Rings
0
Aromatic Rings
1

MOL File


     RDKit          3D

 26 26  0  0  0  0  0  0  0  0999 V2000
   -2.2006    1.5909    1.8842 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6186    1.1654    0.6313 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1167   -0.2262    0.3232 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6398   -0.2916    0.3379 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0034   -1.1370    1.2136 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.3793   -1.2314    1.2628 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.1312   -0.4329    0.3854 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.4885    0.4065   -0.4839 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0844    0.4925   -0.5232 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.5698   -0.5414    0.4473 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.3474    0.1508   -0.3179 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6871   -0.6353   -1.0280 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0551    2.5685    1.9305 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.7273    1.1264    0.6476 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3305    1.8506   -0.1735 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5754   -0.9092    1.0671 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5449   -1.7713    1.9087 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.9078   -1.8864    1.9401 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.0425    1.0227   -1.1600 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3471    1.1776   -1.2361 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.0507   -1.2312    1.1632 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.9751    0.8408   -1.0380 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.4171    0.0469   -0.2470 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4618   -1.7034   -1.2521 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3069    0.0284   -1.8331 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.7853   -0.4706   -0.9628 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0
  2  3  1  0
  3  4  1  0
  4  5  2  0
  5  6  1  0
  6  7  2  0
  7  8  1  0
  8  9  2  0
  7 10  1  0
 10 11  2  3
  3 12  1  0
  9  4  1  0
  1 13  1  0
  2 14  1  0
  2 15  1  0
  3 16  1  0
  5 17  1  0
  6 18  1  0
  8 19  1  0
  9 20  1  0
 10 21  1  0
 11 22  1  0
 11 23  1  0
 12 24  1  0
 12 25  1  0
 12 26  1  0
M  END

Similar Monomers

Structure
Similarity
IUPAC name
MF
Copolymers