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
   -4.5734   -0.1585   -0.4420 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.1070    0.0316   -0.2845 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2738    0.0304   -1.3841 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9116    0.2071   -1.2365 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3180    0.3912   -0.0051 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1549    0.3916    1.0907 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5177    0.2155    0.9499 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.0575    0.5642    0.0840 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.8809   -0.5309    0.2366 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.3417   -1.6592    0.2894 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.3104   -0.3140    0.3261 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.1595   -1.3056    0.4721 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.8702    1.0727    0.2534 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.8139   -0.8944   -1.2353 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.0977    0.7782   -0.7201 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.0175   -0.4933    0.5200 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7273   -0.1142   -2.3668 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2432    0.2074   -2.1043 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7227    0.5332    2.0684 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.1860    0.2153    1.8195 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.2185   -1.1444    0.5384 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.7816   -2.3038    0.5263 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.1427    1.8328    0.5802 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.1188    1.2727   -0.8283 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.7828    1.1745    0.8519 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