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
    4.3525   -0.3611   -0.8127 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.5746   -0.8362    0.1203 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.1908   -0.4126    0.2837 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.4380   -0.9765    1.3091 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.1302   -0.6346    1.5325 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4652    0.2978    0.7185 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.2671    0.8642   -0.3000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.6080    0.5233   -0.5405 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8482    0.7064    0.8992 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8493   -0.1099    0.1353 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.1424    0.3557    0.3713 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5472    0.0506   -1.3475 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.0135    0.3695   -1.5117 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.3853   -0.7530   -0.8454 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.9460   -1.5964    0.8387 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.8701   -1.7254    1.9850 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4385   -1.0975    2.3506 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1509    1.6110   -0.9802 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.1486    0.9785   -1.3360 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0994    0.5752    1.9927 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9487    1.7894    0.6873 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8340   -1.1700    0.3616 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.1694    1.2850    0.6636 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6307   -0.5112   -1.6333 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.3975   -0.3279   -1.9651 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4032    1.1058   -1.6373 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