Monomers

1-(4-Vinylphenyl)-1-propanol

Identifiers

IUPAC name
1-(4-ethenylphenyl)propan-1-ol
InchI
InChI=1S/C11H14O/c1-3-9-5-7-10(8-6-9)11(12)4-2/h3,5-8,11-12H,1,4H2,2H3
InchI Key
FNYDFLXPKVRBLU-UHFFFAOYSA-N
SMILES
CCC(c1ccc(cc1)C=C)O
Canonical SMILES
CCC(C1=CC=C(C=C1)C=C)O
Isomeric SMILES
CCC(C1=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
2.773
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
   -3.9746    0.5573   -0.1215 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4567    0.7850   -0.1965 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8268   -0.4841    0.2922 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3506   -0.3711    0.2655 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.4181   -1.3257    0.9449 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.7855   -1.2680    0.9540 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4060   -0.2275    0.2651 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.6592    0.7023   -0.3966 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.2698    0.6518   -0.4113 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.8648   -0.1832    0.2866 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.5004    0.7656   -0.3388 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3105   -0.7456    1.5858 O   0  0  0  0  0  0  0  0  0  0  0  0
   -4.2096    0.1035    0.8620 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.2202   -0.2052   -0.8973 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.4709    1.5238   -0.2932 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2682    0.9617   -1.2839 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1632    1.6497    0.4195 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1108   -1.2974   -0.4115 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0804   -2.1410    1.4843 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.3956   -2.0100    1.4825 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.0803    1.5342   -0.9500 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3245    1.3849   -0.9321 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.4227   -0.9645    0.8400 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.9922    1.5232   -0.8742 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.5796    0.7714   -0.3044 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6072   -1.6910    1.6115 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
  1 14  1  0
  1 15  1  0
  2 16  1  0
  2 17  1  0
  3 18  1  0
  5 19  1  0
  6 20  1  0
  8 21  1  0
  9 22  1  0
 10 23  1  0
 11 24  1  0
 11 25  1  0
 12 26  1  0
M  END

Similar Monomers

Structure
Similarity
IUPAC name
MF
Copolymers