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
   -2.6388   -1.4123    0.0557 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8983    0.0543   -0.0807 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9053    0.8796    0.6955 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5131    0.6757    0.2725 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.1721    1.5349   -0.5534 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.4642    1.3320   -0.9369 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.1672    0.2182   -0.4993 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.5051   -0.6573    0.3280 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.1848   -0.4254    0.7040 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.5504    0.0296   -0.9282 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.2565   -1.0053   -0.5425 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0750    0.6449    2.0569 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6292   -1.7015    1.1144 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.5107   -1.9449   -0.4097 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7257   -1.7369   -0.4851 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.9903    0.3745   -1.1262 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.9000    0.2520    0.3893 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2095    1.9539    0.5386 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3301    2.4173   -0.9219 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.9675    2.0447   -1.5962 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.0126   -1.5397    0.6943 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3110   -1.1307    1.3557 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.9790    0.7724   -1.5773 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.8887   -1.8010    0.1166 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.2824   -1.0746   -0.9060 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7936   -0.0093    2.2422 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