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
   -4.5094    0.8303    0.6759 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.0994    0.4997    0.3389 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3687    1.2125   -0.5842 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0559    0.8711   -0.8694 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4212   -0.1877   -0.2508 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1539   -0.9019    0.6744 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4763   -0.5604    0.9638 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.8970   -0.5305   -0.5373 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.9690   -0.0149    0.1353 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.7335    0.8157    1.0637 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.3568   -0.3443   -0.1305 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.3739    0.1636    0.5290 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6383   -1.3129   -1.2126 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.5876    1.3398    1.6656 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.0521   -0.1269    0.7589 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.9289    1.5225   -0.0717 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8369    2.0466   -1.0854 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4572    1.4241   -1.5996 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6864   -1.7448    1.1834 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.0285   -1.1403    1.6963 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.2333    0.8847    1.3401 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.3896   -0.1065    0.3014 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.8423   -2.0785   -1.1837 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.6232   -1.8136   -1.1007 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.6051   -0.7475   -2.1719 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