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
   -4.4458   -0.0490    0.7279 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.4941   -0.8994    0.4487 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1600   -0.4892    0.0582 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7453    0.8106   -0.0624 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4600    1.1562   -0.4386 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.4781    0.1737   -0.7141 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0888   -1.1435   -0.6010 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1928   -1.4629   -0.2258 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.8551    0.5084   -1.1173 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.7911    0.6400    0.0594 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.3277    1.6578    0.9042 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.9946   -0.6578    0.7850 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.4329   -0.3754    1.0168 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.2585    1.0043    0.6736 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.7153   -1.9673    0.5129 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4373    1.6025    0.1409 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1592    2.1899   -0.5260 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.7704   -1.9683   -0.8012 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4737   -2.5172   -0.1442 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.2829   -0.2876   -1.7773 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.8550    1.4557   -1.6765 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.7756    0.9861   -0.3709 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.5613    2.5331    0.4571 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.9991   -0.6755    1.2638 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.2414   -0.7351    1.6054 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.9540   -1.4902    0.0748 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