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
   -2.5108    0.2348    1.7704 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8741    0.5857    0.4758 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0855   -0.1724   -0.5509 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6288    0.0603   -0.4512 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.1156    0.6525   -1.4495 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.4602    0.8670   -1.3569 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.1619    0.4872   -0.2187 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.4642   -0.1001    0.7883 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0894   -0.3079    0.6682 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.5785    0.7232   -0.1438 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.3207    0.4006    0.8852 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3913   -1.6410   -0.5505 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8084    0.8886    2.4322 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.9382    0.2938    0.3552 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7859    1.6571    0.3317 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4074    0.2202   -1.5571 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3921    0.9636   -2.3534 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.0342    1.3422   -2.1677 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.9875   -0.4116    1.6997 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4217   -0.7749    1.4873 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.0777    1.1945   -0.9778 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.3969    0.5906    0.9185 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.9384   -0.0747    1.7775 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3496   -2.1196    0.4275 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6325   -2.1460   -1.2018 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.3989   -1.7571   -1.0383 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