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
   -4.5469    0.2047    0.8508 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.0717    0.0466    0.6675 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5382   -0.6937   -0.3662 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1693   -0.8201   -0.5076 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2804   -0.2172    0.3707 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8204    0.5163    1.3948 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1883    0.6445    1.5386 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.0603   -0.3973    0.1526 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.8468    0.4335   -0.6319 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2732    1.4113   -1.1701 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.2449    0.1528   -0.7942 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.0091    0.9234   -1.5307 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.8697   -1.0160   -0.1353 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.7861    1.2810    0.8349 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.0479   -0.3374    0.0080 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.8657   -0.2720    1.8008 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.2379   -1.1675   -1.0566 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7895   -1.4127   -1.3364 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1202    0.9887    2.0831 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5788    1.2306    2.3580 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.5877    1.7864   -2.0274 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.0651    0.7572   -1.6854 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.5759   -0.7272    0.6693 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.0947   -1.6559    0.3289 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.4138   -1.6601   -0.8612 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