Monomers

Isopropyl methacrylate

Identifiers

IUPAC name
propan-2-yl 2-methylprop-2-enoate
InchI
InChI=1S/C7H12O2/c1-5(2)7(8)9-6(3)4/h6H,1H2,2-4H3
InchI Key
BOQSSGDQNWEFSX-UHFFFAOYSA-N
SMILES
CC(OC(=O)C(=C)C)C
Canonical SMILES
CC(C)OC(=O)C(=C)C
Isomeric SMILES
CC(C)OC(=O)C(=C)C
Resources
cid=

Structures

2D Structure
3D Structure

Molecular Formula and Computed Descriptors

Molecular Formula
C7H12O2
Heavy Atom Count
9
Molecular Weight
128.171
Exact Molecular Weight
128.0837
Valence Electrons
52
Radical Electrons
0
tPSA
26.3
MolLogP
1.5141
H Bond Acceptors
2
H Bond Donors
0
Aliphatic Carbocycles
0
Aromatic Carbocycles
0
Aliphatic Heterocycles
0
Aromatic Heterocycles
0
Aliphatic Rings
0
Aromatic Rings
0

MOL File


     RDKit          3D

 21 20  0  0  0  0  0  0  0  0999 V2000
   -2.4785    0.0770    0.8013 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6465    0.4014   -0.4192 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4190   -0.2649   -0.2754 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.7820    0.4203   -0.1873 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.7070    1.6732   -0.2437 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.0703   -0.2733   -0.0366 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.1408   -1.5788    0.0215 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.3371    0.4993    0.0543 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4043   -0.0124   -1.6518 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.0680    0.9402    1.1556 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8227   -0.2298    1.6393 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.0953   -0.8049    0.5395 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5436    1.5027   -0.4526 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.2449   -2.1643   -0.0413 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.0807   -2.0703    0.1308 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.2382    1.4498   -0.5198 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.5899    0.7824    1.0970 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.1232   -0.0876   -0.4277 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2471   -1.0731   -1.9299 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1029    0.6511   -2.4951 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.4861    0.1619   -1.4571 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0
  2  3  1  0
  3  4  1  0
  4  5  2  0
  4  6  1  0
  6  7  2  3
  6  8  1  0
  2  9  1  0
  1 10  1  0
  1 11  1  0
  1 12  1  0
  2 13  1  0
  7 14  1  0
  7 15  1  0
  8 16  1  0
  8 17  1  0
  8 18  1  0
  9 19  1  0
  9 20  1  0
  9 21  1  0
M  END

Similar Monomers

Structure
Similarity
IUPAC name
MF
Copolymers