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
   -2.3208    1.5323   -0.7505 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0320    0.4146   -0.2568 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.1140   -0.4614    0.1179 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8505   -1.6383    0.6373 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.5192   -0.0591   -0.0720 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6967    0.0771   -0.0960 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.2839    1.0124   -0.4977 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.6483    0.5528   -0.2831 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.3004   -0.1449   -1.2785 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6054   -0.6086   -1.1283 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.2706   -0.3652    0.0502 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6291    0.3299    1.0495 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.3465    0.7788    0.8862 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.6274   -2.3368    0.9369 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8320   -1.9250    0.7728 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.6082    0.2762   -1.1470 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.2279   -0.8982    0.0260 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.8257    0.7650    0.6052 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.1341    1.9518    0.0797 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.1336    1.1672   -1.5964 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.8157   -0.3661   -2.2379 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.1229   -1.1505   -1.8913 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.2976   -0.7176    0.1970 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.2070    0.4928    1.9619 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.8593    1.3209    1.6779 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