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
   -4.0368    0.0522    0.7291 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6468    0.1022    0.8264 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0247   -0.0530   -0.5533 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5403    0.0077   -0.3900 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.1174   -0.8857    0.4304 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.4844   -0.8339    0.5842 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.2457    0.1301   -0.0903 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.5393    0.9936   -0.8933 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.1698    0.9586   -1.0611 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6898    0.1701    0.0841 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.4331    1.0662   -0.5376 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4548   -1.3868   -1.1082 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.3443    0.9754    0.5029 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3742    1.1061    1.2561 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2418   -0.6778    1.4976 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3454    0.7294   -1.2353 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4184   -1.6413    0.9677 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.0229   -1.5292    1.2264 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.0705    1.7693   -1.4477 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3390    1.6832   -1.7229 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.1424   -0.5650    0.7464 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.0647    1.8236   -1.2059 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.5210    1.0803   -0.3932 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.5269   -1.2777   -1.4232 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8506   -1.6454   -2.0216 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3572   -2.1521   -0.3142 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