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
   -4.0009   -0.4326   -0.9681 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5966   -0.5013   -1.0644 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0477    0.1613    0.1730 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5739    0.1655    0.2131 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.2161    0.7143   -0.7552 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.6116    0.6913   -0.6684 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.2256    0.1131    0.3986 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.4165   -0.4467    1.3862 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0437   -0.4205    1.2942 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6715    0.0495    0.5605 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.5131    0.5485   -0.3175 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5082    1.6209    0.1447 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.2887   -0.6730   -0.0467 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2448   -1.5366   -1.1837 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2640    0.1250   -1.9313 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4857   -0.3323    1.0513 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2474    1.1826   -1.6183 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.1827    1.1445   -1.4707 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.9225   -0.9122    2.2455 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5558   -0.8725    2.0934 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.0973   -0.4269    1.4383 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.1645    1.0314   -1.2046 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.5805    0.4895   -0.1762 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.5741    1.6486   -0.1670 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4004    2.0940    1.1409 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8573    2.1486   -0.5675 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