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
   -3.8832   -1.4367   -0.1897 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5327   -1.3149   -0.4536 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9613   -0.3157    0.5377 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4960   -0.1169    0.3290 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0280    0.2973   -0.9020 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.3038    0.4920   -1.1380 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.1928    0.2578   -0.0868 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.7456   -0.1552    1.1466 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.3792   -0.3476    1.3646 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.5991    0.4626   -0.3335 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.5101    0.2723    0.5786 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6319    1.0290    0.3217 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.4433   -0.8065   -0.7420 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3962   -1.0010   -1.4890 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0248   -2.2957   -0.3053 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1293   -0.6400    1.5628 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7381    0.4765   -1.7155 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.7113    0.8146   -2.0835 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.4096   -0.3466    1.9864 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.0583   -0.6727    2.3449 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.9250    0.7863   -1.3080 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.5790    0.4310    0.3809 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.2589   -0.0489    1.5676 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5834    1.6423    1.2460 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1378    1.6129   -0.4856 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.6869    0.9238    0.0302 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