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
    4.6480    0.7344   -0.0849 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.7698   -0.0593   -0.6624 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.3712   -0.1737   -0.2832 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.8058    0.5441    0.7329 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.4656    0.3783    1.0328 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3117   -0.5036    0.3191 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.2642   -1.2203   -0.6996 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.5790   -1.0625   -0.9992 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7505   -0.7198    0.5978 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5251    0.2635   -0.2463 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1919    1.5678    0.0508 O   0  0  0  0  0  0  0  0  0  0  0  0
   -4.0129    0.0991   -0.0989 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.3121    1.3492    0.7317 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.6779    0.8064   -0.3778 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.1712   -0.6598   -1.4865 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.4045    1.2560    1.3195 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.0379    0.9712    1.8578 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3468   -1.9234   -1.2717 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.0376   -1.6395   -1.8176 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0639   -1.7401    0.2502 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9669   -0.5949    1.6892 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2652    0.0531   -1.3024 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.9431    2.0385    0.4903 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.2856   -0.9653   -0.0461 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.4020    0.6714    0.7701 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.4791    0.5293   -1.0295 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