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
   -4.6050    0.0163   -0.1188 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.1298    0.0119   -0.2943 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4666   -1.1742   -0.0637 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0989   -1.2095   -0.2184 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3881   -0.0764   -0.5997 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0508    1.1102   -0.8305 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4152    1.1331   -0.6730 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.9864   -0.1575   -0.7432 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.8787    0.0850    0.2765 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.4492    0.3978    1.4047 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.3026   -0.0214    0.0436 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.7453   -0.3522   -1.1512 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.2376    0.2422    1.1473 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.0504   -0.4957   -0.9881 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.8396   -0.4528    0.8474 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.9262    1.0789   -0.1323 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.0107   -2.0699    0.2356 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5565   -2.1108   -0.0477 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4665    1.9782   -1.1274 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.9581    2.0618   -0.8508 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.7952   -0.4487   -1.3908 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.0584   -0.5473   -1.9675 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.7806   -0.6635    1.4868 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.7257    0.6856    2.0213 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.0025    0.9789    0.8256 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