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
   -2.3663   -1.9861   -0.7574 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6583   -0.6599   -1.0231 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1356    0.2368    0.0824 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6633    0.0510    0.1544 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0117   -0.5111    1.2304 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.3584   -0.6656    1.2572 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.1206   -0.2452    0.1703 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.4621    0.3166   -0.9036 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0786    0.4711   -0.9275 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.5584   -0.4114    0.2073 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.3956   -0.0650   -0.7356 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5440    1.6604   -0.0905 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6261   -2.2227    0.1797 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.7338   -0.4819   -1.2369 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1315   -0.4145   -1.9907 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5894   -0.1514    1.0289 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6042   -0.8298    2.0578 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.8691   -1.1135    2.1166 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.0356    0.6565   -1.7727 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3755    0.9222   -1.8065 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.9922   -0.8703    1.1078 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.4615   -0.2190   -0.6411 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.0169    0.3892   -1.6382 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7281    2.2930    0.3584 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.5264    1.8772    0.4047 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6550    1.9736   -1.1471 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