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
    4.4178    0.0232   -0.7794 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.5829    0.4988    0.1086 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.1846    0.1138    0.2394 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.5843   -0.8130   -0.5786 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.2366   -1.1609   -0.4259 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5310   -0.5823    0.5528 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0545    0.3437    1.3759 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.3830    0.6899    1.2292 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9439   -0.9308    0.7315 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8799   -0.0651   -0.0736 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6415   -0.1473   -1.4394 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8120    1.3682    0.4118 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.4453    0.3399   -0.8367 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.0795   -0.7114   -1.4842 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.9924    1.2524    0.8061 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.1621   -1.2946   -1.3682 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1375   -1.8980   -1.1188 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5537    0.7963    2.1446 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.8723    1.4217    1.8689 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2432   -0.8196    1.7976 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1413   -1.9908    0.4718 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.9207   -0.4184    0.1820 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7636   -1.0702   -1.7322 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7981    1.7534    0.2606 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.0535    1.3218    1.5139 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.5753    1.9793   -0.1026 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