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
    0.9891    0.9351    0.9321 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.5326   -0.0602    0.3678 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.8386    0.0806   -0.2881 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.4241   -0.9240   -0.8773 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.5193    1.3967   -0.2866 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.8427   -1.2473    0.4069 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3982   -1.4697    1.0039 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4960   -0.6462    0.4395 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3656    0.1018   -0.7131 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4294    0.8509   -1.1829 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.6502    0.8849   -0.5325 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.7832    0.1374    0.6206 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7173   -0.6085    1.0847 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.9442   -1.8815   -0.8866 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.3729   -0.8029   -1.3487 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.2863    1.3469    0.5387 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.8198    2.2391   -0.0928 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.0676    1.5167   -1.2503 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6411   -2.5442    0.9033 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3565   -1.2358    2.0955 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4265    0.1017   -1.2554 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3411    1.4438   -2.0877 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.4882    1.4649   -0.8881 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.7342    0.1297    1.1764 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8099   -1.2096    2.0037 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