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
    4.5668    0.2595   -0.5329 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.5862    0.9260    0.0346 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.2213    0.4001    0.1883 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.8438   -0.8515   -0.2533 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.5393   -1.3190   -0.0910 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4110   -0.5373    0.5183 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0325    0.7076    0.9566 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2693    1.1787    0.7967 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7981   -0.9903    0.7102 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6994   -0.6293   -0.4513 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.9723   -1.1117   -0.1441 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8245    0.8665   -0.6215 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.5428    0.7592   -0.5887 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.4632   -0.7390   -0.9408 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.7840    1.9337    0.4200 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.6016   -1.4561   -0.7310 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.3363   -2.3090   -0.4672 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7163    1.3974    1.4508 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.5411    2.1607    1.1500 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2502   -0.6149    1.6498 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8363   -2.1107    0.7870 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3699   -1.1023   -1.3820 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.6528   -0.5078   -0.5356 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.7124    1.0365   -1.2710 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.0561    1.3465    0.3474 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9639    1.3066   -1.1391 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