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
    2.2761   -0.9563    1.0356 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.6711    0.0632    0.1277 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.2871   -0.1431   -0.0538 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6851    0.7325    0.3399 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3703    1.7902    0.8974 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0771    0.4103    0.0987 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.0416    1.2374    0.4679 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4163   -0.8671   -0.5724 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.3407    0.1827   -1.2027 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.4825   -1.7170    1.2675 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.1264   -1.5070    0.5906 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.5670   -0.5457    2.0368 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.7688    1.0598    0.6422 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8709    2.1814    0.9594 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.0602    0.9552    0.2677 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.1736   -1.3819    0.0511 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5242   -1.5167   -0.6575 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8071   -0.6961   -1.6052 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.9919    1.1529   -1.6575 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.0694   -0.6164   -1.9133 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.4454    0.1817   -1.1201 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