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
   -2.9153   -3.5145    0.5842 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9652   -2.3573    0.6057 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4102   -1.0569    0.7246 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5181    0.0012    0.7429 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1562   -0.1974    0.6436 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.2885   -1.4959    0.5248 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6040   -2.5515    0.5068 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.7674    0.8366    0.6582 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.1200    1.4025   -0.5562 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.6000    0.9668   -1.6079 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.0743    2.4834   -0.6290 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.6183    2.9376    0.4830 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4238    3.0632   -1.9674 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4973   -4.2551   -0.1142 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.9122   -3.1848    0.2460 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.0072   -3.8907    1.6183 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.4589   -0.8784    0.8029 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8435    1.0397    0.8360 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.3573   -1.6733    0.4454 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2661   -3.5860    0.4132 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.3402    3.7480    0.4793 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.3536    2.5080    1.4287 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.2047    2.3584   -2.7784 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.5161    3.2941   -1.9231 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.8899    4.0025   -2.1674 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