Monomers

p-Tolyl methacrylate

Identifiers

IUPAC name
(4-methylphenyl) 2-methylprop-2-enoate
InchI
InChI=1S/C11H12O2/c1-8(2)11(12)13-10-6-4-9(3)5-7-10/h4-7H,1H2,2-3H3
InchI Key
AOUAMFARIYTDLK-UHFFFAOYSA-N
SMILES
Cc1ccc(cc1)OC(=O)C(=C)C
Canonical SMILES
CC1=CC=C(C=C1)OC(=O)C(=C)C
Isomeric SMILES
CC1=CC=C(C=C1)OC(=O)C(=C)C
Resources
cid=

Structures

2D Structure
3D Structure

Molecular Formula and Computed Descriptors

Molecular Formula
C11H12O2
Heavy Atom Count
13
Molecular Weight
176.215
Exact Molecular Weight
176.0837
Valence Electrons
68
Radical Electrons
0
tPSA
26.3
MolLogP
2.4765
H Bond Acceptors
2
H Bond Donors
0
Aliphatic Carbocycles
0
Aromatic Carbocycles
1
Aliphatic Heterocycles
0
Aromatic Heterocycles
0
Aliphatic Rings
0
Aromatic Rings
1

MOL File


     RDKit          3D

 25 25  0  0  0  0  0  0  0  0999 V2000
   -4.2947    1.3217   -0.9051 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.9438    0.7352   -0.6862 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9474    0.9755   -1.6127 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6951    0.4325   -1.4108 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3733   -0.3490   -0.3211 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3977   -0.5745    0.5965 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6579   -0.0425    0.4167 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.8945   -0.8837   -0.1411 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.8219   -0.1253    0.5661 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.4520    1.0113    1.0044 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.1702   -0.5511    0.8291 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.9924    0.2108    1.5009 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6304   -1.8615    0.3355 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.2114    2.3756   -1.2306 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.8931    1.3287    0.0295 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.7788    0.7335   -1.7135 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2008    1.5887   -2.4671 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.0847    0.6215   -2.1373 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2297   -1.1705    1.4694 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.4583   -0.2223    1.1394 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.7077    1.1963    1.8938 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.0241   -0.0659    1.7268 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.9454   -1.8353   -0.7236 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.8470   -2.6542    0.4564 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.5117   -2.1956    0.9521 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0
  2  3  2  0
  3  4  1  0
  4  5  2  0
  5  6  1  0
  6  7  2  0
  5  8  1  0
  8  9  1  0
  9 10  2  0
  9 11  1  0
 11 12  2  3
 11 13  1  0
  7  2  1  0
  1 14  1  0
  1 15  1  0
  1 16  1  0
  3 17  1  0
  4 18  1  0
  6 19  1  0
  7 20  1  0
 12 21  1  0
 12 22  1  0
 13 23  1  0
 13 24  1  0
 13 25  1  0
M  END

Similar Monomers

Structure
Similarity
IUPAC name
MF
Copolymers