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
   -4.5687    0.3259    0.3174 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.1042    0.0740    0.1306 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3751   -0.6659    1.0384 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0242   -0.8965    0.8634 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3381   -0.3981   -0.2278 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0728    0.3425   -1.1344 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4232    0.5736   -0.9603 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.0181   -0.6275   -0.4069 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.9087    0.2835    0.1344 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.4458    1.2678    0.7580 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.3423    0.1573    0.0173 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.1425    1.0568    0.5539 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.8648   -1.0189   -0.7269 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.7569    0.8569    1.2939 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.1613   -0.6050    0.2472 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.8880    1.0261   -0.4715 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8938   -1.0649    1.8997 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4426   -1.4780    1.5734 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5721    0.7465   -1.9963 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.0108    1.1563   -1.6698 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.2130    0.9487    0.4578 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.7665    1.9047    1.0904 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.8803   -0.8245   -1.1451 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.1877   -1.2390   -1.5846 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.8621   -1.9022   -0.0523 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