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
   -1.4417    2.4083    1.8665 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3440    1.2471    2.5925 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5361    0.0042    1.7208 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5184   -0.0693    0.6469 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9060   -0.0991   -0.6724 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0439   -0.1686   -1.7005 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.3871   -0.2090   -1.4266 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.7649   -0.1784   -0.0950 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.8325   -0.1108    0.8978 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4434   -0.2809   -2.4134 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.1521   -0.3132   -3.6912 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4614   -1.1729    2.6698 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2066    2.2982    0.9088 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4249    1.1163    3.1583 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2209    1.2327    3.3003 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5475    0.0267    1.2960 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9345   -0.0719   -0.9946 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2904   -0.1905   -2.7259 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.8110   -0.2082    0.1679 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.1614   -0.0886    1.9234 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.4958   -0.3092   -2.1055 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.9583   -0.3668   -4.4052 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.1538   -0.2893   -4.0687 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6104   -0.9626    3.3652 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3786   -2.1392    2.1638 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3828   -1.1050    3.3115 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