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
   -4.4261    0.4805   -1.0884 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.0579    0.1521   -0.5925 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4851    0.8567    0.4457 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2087    0.5188    0.8771 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4921   -0.4998    0.3017 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0611   -1.2040   -0.7337 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3523   -0.8708   -1.1787 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.7676   -0.8113    0.7492 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.8947   -0.2159    0.2153 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.7033    0.6270   -0.7032 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.2392   -0.5291    0.6723 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.4430   -1.4002    1.6220 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.3962    0.1506    0.0510 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.3978    0.7638   -2.1558 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.0953   -0.4282   -1.0355 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.9066    1.2342   -0.4433 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.0603    1.6587    0.8921 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7531    1.0645    1.6884 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5019   -2.0073   -1.1911 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8018   -1.4248   -1.9945 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.6087   -1.8947    2.0748 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.4341   -1.6236    1.9509 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.3538   -0.2491    0.4280 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.4050   -0.0393   -1.0552 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.3545    1.2547    0.2034 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