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
    4.2308   -1.8959   -0.4824 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.8121   -0.7739    0.0063 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.3985   -0.5106    0.1976 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.0076    0.7245    0.7314 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.6901    1.0018    0.9230 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3334    0.1248    0.6198 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0717   -1.0851    0.0956 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.3999   -1.3949   -0.1100 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7655    0.4532    0.8391 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3809    1.1139   -0.3764 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2982    0.2645   -1.4785 O   0  0  0  0  0  0  0  0  0  0  0  0
   -3.8642    1.2955   -0.0768 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.5603   -2.6752   -0.7658 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.2852   -2.0876   -0.6233 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.5237   -0.0118    0.2802 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.7891    1.4587    0.9897 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.3978    1.9670    1.3394 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7387   -1.7853   -0.1468 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.6464   -2.3548   -0.5215 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3661   -0.4613    1.0503 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8612    1.1006    1.7254 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9350    2.0908   -0.6011 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5718   -0.6456   -1.2036 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.4304    1.5579   -1.0051 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.2894    0.3994    0.4201 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.9783    2.1295    0.6639 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