Monomers

Benzyl methacrylate

Identifiers

IUPAC name
benzyl 2-methylprop-2-enoate
InchI
InChI=1S/C11H12O2/c1-9(2)11(12)13-8-10-6-4-3-5-7-10/h3-7H,1,8H2,2H3
InchI Key
AOJOEFVRHOZDFN-UHFFFAOYSA-N
SMILES
O=C(C(=C)C)OCc1ccccc1
Canonical SMILES
CC(=C)C(=O)OCC1=CC=CC=C1
Isomeric SMILES
CC(=C)C(=O)OCC1=CC=CC=C1
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
2.3059
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
    2.2824   -1.6945    0.1800 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.0262   -0.4765   -0.0221 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.0945    0.4850   -0.2226 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.8459    1.7607   -0.4349 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.5007    0.0195   -0.1875 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.6804   -0.1375   -0.0372 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3286   -1.1371    0.1679 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6747   -0.5744    0.1140 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7641   -1.3853    0.2892 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.0540   -0.8789    0.2431 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.2021    0.4645    0.0158 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.1443    1.3251   -0.1670 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8776    0.7603   -0.1101 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.8333    2.1652   -0.4721 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.6357    2.4693   -0.5827 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.7305   -0.5125    0.7787 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.6511   -0.6664   -1.0538 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.2017    0.8689   -0.3391 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1168   -1.5315    1.2040 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2031   -1.9862   -0.5255 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6827   -2.4647    0.4731 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.9088   -1.5377    0.3845 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.2073    0.8606   -0.0204 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.3004    2.3768   -0.3437 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0181    1.4271   -0.2530 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  1  0
  8  9  2  0
  9 10  1  0
 10 11  2  0
 11 12  1  0
 12 13  2  0
 13  8  1  0
  4 14  1  0
  4 15  1  0
  5 16  1  0
  5 17  1  0
  5 18  1  0
  7 19  1  0
  7 20  1  0
  9 21  1  0
 10 22  1  0
 11 23  1  0
 12 24  1  0
 13 25  1  0
M  END

Similar Monomers

Structure
Similarity
IUPAC name
MF
Copolymers