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
    4.4475   -1.4469    0.3979 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.8453   -0.4850   -0.2507 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4493   -0.1512   -0.0807 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.6263   -0.8243    0.7873 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.2823   -0.4910    0.9405 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2622    0.5392    0.2126 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.5591    1.2130   -0.6554 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.8834    0.8819   -0.8041 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6906    0.9028    0.3672 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5852    0.1537   -0.5822 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4555   -1.2071   -0.3405 O   0  0  0  0  0  0  0  0  0  0  0  0
   -4.0183    0.5595   -0.2518 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.9368   -2.0681    1.1164 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.5028   -1.6858    0.2575 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.4316    0.0890   -0.9526 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.0198   -1.6590    1.3930 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3467   -1.0513    1.6445 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.1421    2.0248   -1.2331 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.5047    1.4298   -1.4945 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9854    0.6109    1.3992 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8575    2.0041    0.3022 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4086    0.4022   -1.6377 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.0824   -1.7279   -0.9066 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.6922   -0.0073   -0.8973 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.1767    0.3351    0.8285 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.0698    1.6589   -0.4179 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