Monomers

1-(4-Vinylphenyl)-2-propanol

Identifiers

IUPAC name
1-(4-ethenylphenyl)propan-2-ol
InchI
InChI=1S/C11H14O/c1-3-10-4-6-11(7-5-10)8-9(2)12/h3-7,9,12H,1,8H2,2H3
InchI Key
LLWNVRSHEMAPGD-UHFFFAOYSA-N
SMILES
C=Cc1ccc(cc1)CC(O)C
Canonical SMILES
CC(CC1=CC=C(C=C1)C=C)O
Isomeric SMILES
CC(CC1=CC=C(C=C1)C=C)O
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
2.2529
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
    4.2794   -1.3522    0.5426 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.7099   -0.1876    0.3913 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.2811   -0.0447    0.1141 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.7709    1.2246   -0.0298 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.4339    1.4280   -0.2917 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4608    0.3897   -0.4237 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0520   -0.8856   -0.2791 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.4088   -1.0997   -0.0130 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8749    0.5456   -0.6986 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7833    0.6665    0.4653 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.0955    0.8080    0.0082 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7604   -0.6182    1.2906 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.7756   -2.3097    0.4820 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.3347   -1.4084    0.7455 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.3374    0.7023    0.4779 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.4343    2.0870    0.0647 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.0334    2.4211   -0.4046 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5581   -1.7827   -0.3621 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.8046   -2.0945    0.0991 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0075    1.4524   -1.3501 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2138   -0.3101   -1.3206 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5898    1.4850    1.1505 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.1403    1.6876   -0.4373 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.2021   -1.4671    0.7673 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.2634   -0.4549    2.2812 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7060   -0.8826    1.5438 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  2  0
  6  7  1  0
  7  8  2  0
  6  9  1  0
  9 10  1  0
 10 11  1  0
 10 12  1  0
  8  3  1  0
  1 13  1  0
  1 14  1  0
  2 15  1  0
  4 16  1  0
  5 17  1  0
  7 18  1  0
  8 19  1  0
  9 20  1  0
  9 21  1  0
 10 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