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
   -3.8934    0.8202   -0.9733 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5220    0.8152   -0.9079 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0183   -0.0314    0.2713 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5717    0.0260    0.2545 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0700    0.6692    1.2931 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.4402    0.7725    1.3600 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.2491    0.2260    0.3708 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.6135   -0.4108   -0.6574 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.2411   -0.5101   -0.7173 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6935    0.3375    0.4458 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.5225   -0.1447   -0.4358 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6466   -1.3695    0.1742 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.3497    0.5457   -0.1434 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1372    1.8511   -0.6877 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0335    0.4832   -1.8435 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4068    0.4817    1.1708 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5019    1.1259    2.1115 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.9384    1.2746    2.1709 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.2020   -0.8526   -1.4519 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2504   -1.0156   -1.5347 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.1168    0.8679    1.3103 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.5934   -0.0314   -0.3285 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.2002   -0.6767   -1.3109 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.2537   -1.4821   -0.7546 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.3535   -1.5522    1.0117 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9420   -2.2195    0.1775 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