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
    4.3904    0.5427    0.9460 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.5563   -0.4814    0.9584 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.2052   -0.3988    0.4109 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.4027   -1.5341    0.4717 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.1153   -1.5276   -0.0264 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4167   -0.3945   -0.6006 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.3754    0.7289   -0.6615 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.6799    0.7264   -0.1581 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7809   -0.3945   -1.1263 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8171    0.0075   -0.1061 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.0811   -0.0211   -0.6940 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6116    1.4216    0.3906 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.3798    0.4057    1.3718 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.1506    1.5138    0.5372 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.8913   -1.4196    1.3931 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.7829   -2.4494    0.9165 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4645   -2.4588    0.0537 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0035    1.6313   -1.1016 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.2839    1.6217   -0.2172 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8287    0.2511   -2.0051 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0616   -1.4219   -1.4672 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8446   -0.7025    0.7463 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.4633   -0.9469   -0.7042 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9919    1.3671    1.3093 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.6074    1.8323    0.7260 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2409    2.1012   -0.3725 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