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
   -2.2893   -1.2217    0.7193 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6325   -0.1956   -0.1907 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2997    0.0674    0.1884 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.7831   -0.2322   -0.6258 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.5390   -0.7575   -1.7383 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.1615    0.0424   -0.2278 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.1451   -0.2624   -1.0388 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4824    0.6641    1.0841 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4770    1.0443   -0.2474 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.3926   -1.1358    0.4981 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9770   -2.2464    0.4142 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1423   -1.0130    1.7748 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6315   -0.6616   -1.2100 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.9402   -0.7093   -1.9856 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.1647   -0.0686   -0.7650 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.6126    0.6797    1.7505 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.3540    0.1760    1.5318 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.7675    1.7337    0.8910 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9389    1.8913    0.2192 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.4570    0.8506    0.2442 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7122    1.3546   -1.2863 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