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
   -4.5605   -0.6967   -0.0785 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.0789   -0.6097   -0.0424 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3755   -0.7885    1.1515 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0078   -0.7025    1.1543 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2745   -0.4441    0.0201 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9833   -0.2682   -1.1599 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3710   -0.3512   -1.1853 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.1107   -0.3530    0.0016 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.7955    0.8223    0.2019 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.1239    1.8621    0.4117 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.2546    0.9110    0.1810 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.8596    2.0542    0.3774 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.0823   -0.2932   -0.0632 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.0081   -0.1006   -0.8726 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.9614   -0.4066    0.9368 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.8085   -1.7674   -0.2400 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.9693   -0.9908    2.0323 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4897   -0.8432    2.0816 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4811   -0.0659   -2.0720 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.9353   -0.2159   -2.0999 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.9257    2.1173    0.3618 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.2758    2.9349    0.5555 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.0248   -0.1764    0.5105 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.2910   -0.4584   -1.1354 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.5611   -1.1697    0.4081 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