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
    4.4264    0.9446    0.4609 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.5964   -0.0426    0.6444 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.2268   -0.0572    0.1478 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.4239   -1.1735    0.4049 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.1237   -1.2346   -0.0433 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4265   -0.1902   -0.7627 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.3549    0.8888   -1.0093 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.6788    0.9806   -0.5677 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8230   -0.3591   -1.1929 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8385    0.1451   -0.2134 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6948    1.5024    0.0428 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.9052   -0.6821    1.0478 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.1307    1.8178   -0.0804 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.4220    0.8849    0.8567 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.9579   -0.9084    1.2062 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.8720   -1.9785    0.9683 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4742   -2.1366    0.1832 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0584    1.7105   -1.5682 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.2705    1.8645   -0.7875 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0609   -1.4156   -1.4250 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9562    0.2129   -2.1343 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.8353    0.0282   -0.7079 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.5001    1.9146    0.4032 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.9348   -0.6279    1.5096 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7626   -1.7430    0.7880 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2137   -0.3456    1.8288 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