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
   -4.6110   -0.4359    0.2430 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.1577   -0.1551    0.0531 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4723    0.5227    1.0274 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1256    0.7945    0.8740 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4308    0.3999   -0.2483 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1358   -0.2808   -1.2182 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4933   -0.5571   -1.0682 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.9200    0.6915   -0.3651 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.9252   -0.1354    0.0769 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.5951   -1.2212    0.6195 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.3411    0.1773   -0.0491 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6996    1.3128   -0.6162 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.4142   -0.7173    0.4288 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.7688   -0.7138    1.3058 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.2566    0.3740   -0.1090 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.8831   -1.3491   -0.3458 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.9893    0.8499    1.9278 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6246    1.3230    1.6505 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6621   -0.6137   -2.1079 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.0558   -1.0946   -1.8311 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.9158    1.9741   -0.9692 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.7496    1.5994   -0.7374 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.0420   -1.6692    0.8356 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.9612   -0.1741    1.2319 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.1031   -0.9017   -0.4168 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