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
   -2.4815    0.0091    1.5292 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8567   -0.4033    0.2420 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0453    0.3024   -0.8300 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5891    0.0170   -0.6707 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.1173    0.4261    0.4393 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.4832    0.1539    0.5808 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.1753   -0.5325   -0.3819 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.4557   -0.9427   -1.5006 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.1105   -0.6761   -1.6426 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6038   -0.8365   -0.2702 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.3031   -0.4701    0.7585 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3363    1.7796   -0.8538 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.1233   -0.4296    2.1441 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7586   -1.4892    0.1955 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.9338   -0.1571    0.1521 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3976   -0.1115   -1.7977 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3734    0.9683    1.2264 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.9767    0.5017    1.4733 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.0125   -1.4835   -2.2535 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4441   -1.0022   -2.5234 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.1147   -1.3901   -1.0715 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.9319    0.0740    1.6089 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.3764   -0.7151    0.8111 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5064    2.2023    0.1431 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.2852    1.9290   -1.4250 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5299    2.2761   -1.4236 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