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
    0.8814    0.7198    1.1673 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.5154    0.3049    0.1487 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.7692   -0.4428    0.2992 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.4220   -0.8704   -0.7576 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.3087   -0.7213    1.6523 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.9717    0.5898   -1.0890 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2208    1.2985   -1.2485 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3968    0.6529   -0.6230 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3589   -0.6331   -0.1352 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4905   -1.1892    0.4454 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.6825   -0.4936    0.5585 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.7097    0.7959    0.0658 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5802    1.3448   -0.5112 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.0266   -0.6658   -1.7317 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.3469   -1.4238   -0.6985 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.7647   -1.7346    1.7208 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.5758   -0.6036    2.4554 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.1483   -0.0083    1.8319 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1643    2.3400   -0.8503 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3688    1.4346   -2.3596 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4614   -1.2377   -0.1917 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4851   -2.2140    0.8422 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.5535   -0.9568    1.0190 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.6329    1.3568    0.1448 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6251    2.3568   -0.8903 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