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
   -4.0149   -0.6922    0.3422 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5277   -0.8138    0.1941 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8742    0.5423    0.0032 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3963    0.3739   -0.1398 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.1431    0.3919   -1.4132 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.4894    0.2444   -1.6344 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.3237    0.0720   -0.5237 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.8100    0.0506    0.7549 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.4321    0.2042    0.9398 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.7414   -0.0808   -0.7941 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.5951   -0.2468    0.1830 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1813    1.4320    1.0184 O   0  0  0  0  0  0  0  0  0  0  0  0
   -4.3818    0.2470   -0.0886 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.5699   -1.5231   -0.1834 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.3626   -0.7261    1.3939 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0738   -1.3403    1.0708 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3161   -1.3987   -0.7277 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2806    0.9718   -0.9349 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5418    0.5295   -2.2645 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.8917    0.2613   -2.6374 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.4325   -0.0801    1.6156 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.0210    0.1891    1.9326 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.0879   -0.0542   -1.8443 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.3290   -0.2810    1.2018 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.6505   -0.3576   -0.0633 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4264    2.0849    1.0582 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