Monomers

Phenyl methacrylate

Identifiers

IUPAC name
phenyl 2-methylprop-2-enoate
InchI
InChI=1S/C10H10O2/c1-8(2)10(11)12-9-6-4-3-5-7-9/h3-7H,1H2,2H3
InchI Key
QIWKUEJZZCOPFV-UHFFFAOYSA-N
SMILES
O=C(C(=C)C)Oc1ccccc1
Canonical SMILES
CC(=C)C(=O)OC1=CC=CC=C1
Isomeric SMILES
CC(=C)C(=O)OC1=CC=CC=C1
Resources
cid=

Structures

2D Structure
3D Structure

Molecular Formula and Computed Descriptors

Molecular Formula
C10H10O2
Heavy Atom Count
12
Molecular Weight
162.188
Exact Molecular Weight
162.0681
Valence Electrons
62
Radical Electrons
0
tPSA
26.3
MolLogP
2.1681
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

 22 22  0  0  0  0  0  0  0  0999 V2000
    0.8314    0.6551    1.3952 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.2087    0.1791    0.2815 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.6044    0.1249   -0.0566 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.0062   -0.3683   -1.2123 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6199    0.6233    0.8892 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.1892   -0.2694   -0.5532 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1536   -0.1951   -0.1787 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9366    0.9028   -0.4588 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.2525    0.8930   -0.0527 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.8011   -0.1902    0.6267 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.9917   -1.2750    0.8926 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6719   -1.2831    0.4937 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.0445   -0.4210   -1.4914 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.2822   -0.7378   -1.9182 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.8688    1.6907    0.6328 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.2874    0.6194    1.9416 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.5786    0.0731    0.8411 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4873    1.7183   -0.9814 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.8855    1.7439   -0.2619 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.8202   -0.2000    0.9422 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.4380   -2.1234    1.4298 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0830   -2.1605    0.7289 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  2  0
  2  3  1  0
  3  4  2  3
  3  5  1  0
  2  6  1  0
  6  7  1  0
  7  8  2  0
  8  9  1  0
  9 10  2  0
 10 11  1  0
 11 12  2  0
 12  7  1  0
  4 13  1  0
  4 14  1  0
  5 15  1  0
  5 16  1  0
  5 17  1  0
  8 18  1  0
  9 19  1  0
 10 20  1  0
 11 21  1  0
 12 22  1  0
M  END

Similar Monomers

Structure
Similarity
IUPAC name
MF
Copolymers