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
   -2.7565    1.6773    0.3073 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8687    0.3570    0.6729 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9946   -0.5615   -0.1444 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5719   -0.2609   -0.0508 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0018    0.9365   -0.4195 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.3507    1.1803   -0.3151 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.2272    0.2046    0.1810 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.6551   -0.9873    0.5479 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.2837   -1.2246    0.4377 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6416    0.5066    0.2730 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.5145   -0.3515    0.7241 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4490   -0.5399   -1.6002 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.4431    2.1844    0.8087 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.9320    0.0510    0.4429 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7167    0.1459    1.7305 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1793   -1.5899    0.2168 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6899    1.6939   -0.8062 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.7354    2.1433   -0.6227 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.2689   -1.7832    0.9378 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1052   -2.1862    0.7443 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.9888    1.4834   -0.0452 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.2004   -1.3213    1.0445 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.5543   -0.0857    0.7752 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7043    0.4741   -1.9415 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.3884   -1.1571   -1.6899 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6228   -0.9892   -2.1968 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