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
   -3.9510   -0.9754   -0.2768 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4730   -0.9661   -0.0566 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8712    0.4095   -0.2813 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4062    0.3334   -0.0434 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.5257    0.4125   -1.0366 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.8900    0.3311   -0.7207 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.3191    0.1733    0.5646 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.3502    0.0961    1.5519 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0027    0.1735    1.2667 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.7141    0.0878    0.9079 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.6560    0.1579   -0.0086 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3747    1.2857    0.7083 O   0  0  0  0  0  0  0  0  0  0  0  0
   -4.3160   -0.0186   -0.7303 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.4730   -1.0638    0.7165 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.2476   -1.7875   -0.9602 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9586   -1.6954   -0.7158 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1978   -1.2786    0.9931 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1218    0.7791   -1.2908 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.1805    0.5373   -2.0517 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.5672    0.3979   -1.5253 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.6670   -0.0306    2.5922 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7049    0.1053    2.0934 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.0159   -0.0370    1.9373 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.7261    0.0910    0.2671 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.5062    0.2811   -1.0692 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0250    2.2004    0.4913 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