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
   -2.1480    1.8100   -0.4722 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9956    0.6095   -0.1987 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.1516   -0.2464   -0.0371 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.9889   -1.5197    0.2530 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.5036    0.3030   -0.1962 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6876    0.1490   -0.0608 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.3946    1.0572   -0.2361 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.6965    0.3876   -0.0514 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.8288   -0.9427    0.2506 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.0819   -1.5043    0.4098 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.2100   -0.7084    0.2611 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.1023    0.6298   -0.0421 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.8354    1.1538   -0.1932 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0054   -1.9374    0.3728 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.8310   -2.1880    0.3808 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.1838   -0.2537    0.4752 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.5579    1.3902    0.0548 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.7914    0.1852   -1.2755 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.3101    1.8363    0.5567 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.3171    1.5439   -1.2502 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.9497   -1.5626    0.3665 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.1846   -2.5648    0.6505 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.2054   -1.1093    0.3774 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.9615    1.2698   -0.1629 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.7668    2.2121   -0.4324 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