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
   -2.8098    1.0990    0.3157 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.9086   -0.3907    0.3151 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9135   -1.0371   -0.6303 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5294   -0.7057   -0.2714 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.2455   -1.5968    0.4367 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.5411   -1.2881    0.7718 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.1576   -0.0744    0.4278 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.3689    0.8020   -0.2785 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0464    0.4866   -0.6204 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.5317    0.1835    0.8160 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.1305    1.2983    0.5117 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2011   -0.7047   -1.9349 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8915    1.4644   -0.7310 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.7095    1.4839    0.8751 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9001    1.4794    0.7836 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.9467   -0.6647    0.0649 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7264   -0.7875    1.3406 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0924   -2.1511   -0.5529 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2046   -2.5589    0.7238 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.1651   -1.9799    1.3298 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.7576    1.7551   -0.5841 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5517    1.1962   -1.1783 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.1112   -0.5464    1.3759 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.1574    1.5297    0.7836 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.6160    2.0568   -0.0376 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4437   -0.3489   -2.4409 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