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
   -2.0162    1.3750    1.8347 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9662    0.7632    0.7564 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.1705    0.5553   -0.0155 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.3094    1.0120    0.4238 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.1002   -0.1748   -1.2985 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7219    0.2886    0.3203 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.4429    0.5229    1.1262 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.6473   -0.0550    0.4919 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4197    0.6914   -0.3878 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.5484    0.1899   -0.9993 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.9342   -1.1240   -0.7245 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.1718   -1.8792    0.1517 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.0461   -1.3518    0.7501 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.3531    1.5417    1.3571 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.2154    0.8678   -0.1350 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.9105    0.1343   -1.9932 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.1249   -1.2900   -1.1278 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1472    0.0056   -1.8476 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.2862    0.1491    2.1680 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.5272    1.6399    1.1935 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.0629    1.7163   -0.5615 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.1150    0.8216   -1.6803 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.8246   -1.5141   -1.2091 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.5108   -2.8936    0.3339 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.4984   -1.9922    1.4209 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