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
    2.6494   -1.7868   -0.4918 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.6804   -0.9732    0.6409 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.0744    0.3806    0.3575 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.6629    0.2918   -0.0709 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.2151    0.7273   -1.2965 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1141    0.6313   -1.6711 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0583    0.0877   -0.8202 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6143   -0.3535    0.4171 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2728   -0.2515    0.7832 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.4452   -0.0010   -1.2381 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.4200   -0.4944   -0.5183 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.1483    1.1901    1.6324 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.3466   -1.5357   -1.1458 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.2730   -1.4658    1.5275 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.7696   -0.7858    0.8461 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.6857    0.8431   -0.4538 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.9321    1.1583   -1.9856 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4394    0.9816   -2.6411 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3024   -0.7868    1.1244 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.0010   -0.6231    1.7799 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.6962    0.3718   -2.2278 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.4348   -0.5404   -0.8686 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.2060   -0.8710    0.4636 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.1499    1.6949    1.7415 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.4070    2.0135    1.5817 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.0083    0.5894    2.5339 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