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
   -4.0284    0.7402   -0.4547 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5339    0.8344   -0.6854 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8570   -0.0712    0.2792 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3994   -0.1146    0.2067 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.2548   -1.1445    0.8524 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.6250   -1.2833    0.8500 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4030   -0.3589    0.1753 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.7826    0.6683   -0.4709 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.3979    0.7782   -0.4480 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.8565   -0.5307    0.1892 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.6984    0.2776   -0.4120 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3177   -1.3743    0.0418 O   0  0  0  0  0  0  0  0  0  0  0  0
   -4.2625    0.1654    0.4846 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.5558    0.2476   -1.2970 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.4956    1.7382   -0.3090 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2600    1.8886   -0.6217 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3601    0.5136   -1.7346 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1597    0.1708    1.3185 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3088   -1.9050    1.4021 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.1227   -2.1040    1.3661 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.3685    1.4006   -1.0032 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0669    1.5952   -0.9640 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.2766   -1.3849    0.7332 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.3550    1.1445   -0.9698 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.7629    0.0459   -0.3307 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2983   -1.9376    0.8392 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