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
   -2.4390    0.6923   -0.9083 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7096    0.1797    0.3099 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3994   -0.2349   -0.0614 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.7275    0.3567    0.5142 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.5052    1.2574    1.3608 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.0625   -0.0427    0.1576 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.3151   -0.9729   -0.7165 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.2179    0.6370    0.8167 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3913   -1.0394    0.9089 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7366    0.9288   -1.7378 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.9693    1.6450   -0.6784 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.1869   -0.0726   -1.2528 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6978    0.9717    1.0575 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.4623   -1.4672   -1.1960 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.3191   -1.2721   -0.9836 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.5928    0.0838    1.6884 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.9361    1.6820    1.1349 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.0063    0.7345    0.0422 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5314   -1.7654    0.0754 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.3691   -0.8071    1.3374 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7144   -1.4942    1.6444 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