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
   -0.7517    1.2410   -0.9630 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1897    0.3579   -0.1854 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6371    0.1867    0.0561 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.4357    1.0007   -0.5805 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.1235   -0.8727    0.9864 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2643   -0.4605    0.4466 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.0785   -0.2533    0.1815 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.8666    0.5971    0.9078 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.1929    0.7598    0.5952 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.7366    0.0577   -0.4633 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.9565   -0.7947   -1.1952 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.6245   -0.9564   -0.8791 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.0521    1.7464   -1.2381 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.4986    0.9334   -0.4527 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.9398   -0.5626    2.0255 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.2356   -0.9028    0.8648 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7197   -1.8641    0.7574 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.4368    1.1488    1.7406 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.8274    1.4418    1.1768 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.7918    0.1944   -0.7032 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.3490   -1.3615   -2.0318 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.9873   -1.6373   -1.4584 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