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
    2.8635    1.2968    0.4232 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.8055   -0.1470    0.8686 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.9467   -0.9535   -0.0203 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.5387   -0.5665   -0.1274 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2511   -1.3456   -0.9625 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5920   -1.0929   -1.1449 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2270   -0.0290   -0.4909 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4339    0.7287    0.3286 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0677    0.4720    0.5152 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.6427    0.2277   -0.6916 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.3148    1.1968   -0.1223 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.1380   -2.3228    0.2339 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.8886    1.5591    0.0167 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.2005    1.4234   -0.4710 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.6914    2.0262    1.2211 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.8549   -0.5454    0.7787 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.5738   -0.2407    1.9487 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.3616   -0.8083   -1.0726 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.1915   -2.1920   -1.5005 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2341   -1.6843   -1.7908 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8725    1.5713    0.8648 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.5099    1.0841    1.1662 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.2162   -0.4292   -1.3698 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.3667    1.3535   -0.2982 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.8112    1.8683    0.5475 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.4653   -2.4506    1.1494 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