Monomers

2-(4-Ethenylphenyl)propan-1-ol

Identifiers

IUPAC name
2-(4-ethenylphenyl)propan-1-ol
InchI
InChI=1S/C11H14O/c1-3-10-4-6-11(7-5-10)9(2)8-12/h3-7,9,12H,1,8H2,2H3
InchI Key
IWONVDRULKJRQP-UHFFFAOYSA-N
SMILES
OCC(c1ccc(cc1)C=C)C
Canonical SMILES
CC(CO)C1=CC=C(C=C1)C=C
Isomeric SMILES
CC(CO)C1=CC=C(C=C1)C=C
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
2.4254
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
   -2.6672   -1.6803    0.1059 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7221   -0.5678    0.9217 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9594    0.6220    0.3316 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5352    0.3116    0.1319 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.3873    1.0380    0.8492 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.7573    0.7828    0.6920 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.1791   -0.1927   -0.1785 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.1969   -0.9056   -0.8868 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1418   -0.6703   -0.7461 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.5785   -0.4998   -0.3816 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.5520    0.1045    0.2266 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6320    0.9389   -0.9868 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.3777   -2.2984    0.3969 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3239   -0.8178    1.9279 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.7904   -0.3087    1.0599 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0924    1.5102    1.0040 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.1380    1.8177    1.5499 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.4859    1.3463    1.2491 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.5054   -1.6726   -1.5725 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8866   -1.2403   -1.3133 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.8296   -1.2958   -1.0968 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.3652    0.8828    0.9292 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.5786   -0.1868    0.0171 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4768    1.9848   -1.2865 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.7311    0.7195   -0.9075 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2175    0.2779   -1.7859 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
  2 14  1  0
  2 15  1  0
  3 16  1  0
  5 17  1  0
  6 18  1  0
  8 19  1  0
  9 20  1  0
 10 21  1  0
 11 22  1  0
 11 23  1  0
 12 24  1  0
 12 25  1  0
 12 26  1  0
M  END

Similar Monomers

Structure
Similarity
IUPAC name
MF
Copolymers