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
   -2.9162    1.2536    0.6466 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7711   -0.0362    1.0826 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8876   -0.8886    0.2031 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5107   -0.3625    0.0877 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2354    0.8929   -0.4276 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.0557    1.3613   -0.5249 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.1258    0.5748   -0.1028 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.8180   -0.6656    0.4036 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.5296   -1.1607    0.5125 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.4739    1.1018   -0.2206 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.5125    0.3909    0.1663 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5136   -0.9783   -1.1769 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.4220    1.3577   -0.1845 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3938   -0.0259    2.1232 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.7659   -0.5154    1.1030 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9021   -1.9097    0.6340 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0686    1.5128   -0.7597 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.2037    2.3460   -0.9345 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.6059   -1.3142    0.7442 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.3230   -2.1510    0.9199 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.6282    2.0857   -0.6290 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.4779   -0.5970    0.5860 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.5238    0.8038    0.0704 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1327   -1.9141   -1.6669 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.6145   -1.0133   -1.1086 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1440   -0.1487   -1.8180 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