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
   -2.6945    0.2099   -1.4870 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8547   -0.7023   -0.2972 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0625   -0.2475    0.8832 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5997   -0.1744    0.6348 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0066    0.8544   -0.0501 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.3838    0.8824   -0.2617 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.1932   -0.1188    0.2065 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.5908   -1.1697    0.9037 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.2295   -1.1745    1.0995 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6485   -0.1408    0.0128 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.3235    0.7794   -0.6186 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5870    0.9836    1.2968 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6903    0.1079   -1.9057 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8778    1.2520   -1.1055 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.4974    0.0452   -2.2452 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.9242   -0.6779   -0.0076 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6251   -1.7455   -0.5939 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2254   -0.9306    1.7617 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6160    1.6629   -0.4314 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.8143    1.7099   -0.8045 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.2247   -1.9620    1.2751 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2323   -1.9974    1.6441 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.2196   -0.9875    0.4248 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.3994    0.7141   -0.7332 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.8081    1.6308   -1.0412 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3548    1.1964    2.2315 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