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
   -2.4849    1.7813    0.3086 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7579    0.5429    0.8480 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0473   -0.5864    0.1334 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5813   -0.4375    0.1741 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0567    0.6513   -0.4133 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.4352    0.7594   -0.3561 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.2032   -0.1882    0.2713 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.5472   -1.2713    0.8538 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.1725   -1.3971    0.8073 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6358   -0.0551    0.3185 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.3209    0.9358   -0.2070 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5156   -0.7265   -1.2970 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.2926    2.3549    0.2812 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.8505    0.3774    0.7655 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4144    0.4929    1.9148 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3252   -1.5179    0.6589 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5151    1.4171   -0.9160 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.8535    1.6336   -0.8359 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.1856   -1.9936    1.3366 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2680   -2.2664    1.2824 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.2060   -0.8429    0.8341 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.4051    0.9894   -0.1434 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.8599    1.7539   -0.7309 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5593    0.2278   -1.8355 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.5067   -1.2580   -1.3578 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7628   -1.3770   -1.8201 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