Monomers

1-(4-Vinylphenyl)-2-propanol

Identifiers

IUPAC name
1-(4-ethenylphenyl)propan-2-ol
InchI
InChI=1S/C11H14O/c1-3-10-4-6-11(7-5-10)8-9(2)12/h3-7,9,12H,1,8H2,2H3
InchI Key
LLWNVRSHEMAPGD-UHFFFAOYSA-N
SMILES
C=Cc1ccc(cc1)CC(O)C
Canonical SMILES
CC(CC1=CC=C(C=C1)C=C)O
Isomeric SMILES
CC(CC1=CC=C(C=C1)C=C)O
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
2.2529
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
    4.1627    1.1184    0.9570 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6084    0.1126    0.3305 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.1953    0.1033   -0.0454 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.3509    1.1224    0.2198 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0232    1.0517   -0.1631 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5198   -0.0260   -0.8211 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.3522   -1.0621   -1.0872 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.6726   -1.0118   -0.7160 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9273   -0.0768   -1.2155 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8366   -0.6740   -0.1774 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4699   -1.9814    0.1157 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.9611    0.1868    1.0500 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6359    2.0069    1.2433 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.2103    1.0939    1.2207 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.2489   -0.7457    0.0885 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.7302    2.0058    0.7419 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5970    1.8881    0.0737 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0129   -1.9472   -1.6063 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.3789   -1.8075   -0.9108 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3467    0.8978   -1.5375 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9987   -0.7455   -2.1176 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.8529   -0.7306   -0.6342 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9377   -2.0753    0.9222 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2919   -0.1033    1.8670 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8152    1.2426    0.7239 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.0017    0.1569    1.4777 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  2  3
  2  3  1  0
  3  4  2  0
  4  5  1  0
  5  6  2  0
  6  7  1  0
  7  8  2  0
  6  9  1  0
  9 10  1  0
 10 11  1  0
 10 12  1  0
  8  3  1  0
  1 13  1  0
  1 14  1  0
  2 15  1  0
  4 16  1  0
  5 17  1  0
  7 18  1  0
  8 19  1  0
  9 20  1  0
  9 21  1  0
 10 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