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
   -4.0656   -0.6309    0.0869 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7055   -0.8717   -0.1097 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0054    0.4678    0.1497 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5542    0.3658   -0.0220 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.1795   -0.5391    0.7180 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.5410   -0.6926    0.6130 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.2172    0.1260   -0.3061 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.5034    1.0339   -1.0526 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.1149    1.1591   -0.9152 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6619   -0.0494   -0.4053 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.3867    0.6560   -1.2229 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3310    0.8233    1.5950 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.2931    0.2722   -0.2499 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3235   -1.6093    0.6115 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5822   -1.1827   -1.1668 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4895    1.2100   -0.4792 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3685   -1.1745    1.4357 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.0962   -1.4170    1.2113 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.0034    1.6773   -1.7690 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3682    1.8971   -1.5401 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.1817   -0.7810    0.2058 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.9406    1.3932   -1.8532 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.4643    0.5401   -1.3115 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4599    1.4095    1.9707 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4666   -0.1232    2.1811 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.2777    1.4247    1.6249 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