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
    2.0219    0.2528   -1.6556 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.6342    0.2478   -0.1941 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.3242   -0.2528   -0.1198 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6738    0.5772    0.3364 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3592    1.7667    0.6713 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0575    0.1912    0.4621 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.9490    1.0292    0.9015 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4398   -1.1766    0.0808 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.6018   -0.5558    0.6417 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.1976    0.8056   -2.1871 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.9940   -0.7734   -2.0552 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.9685    0.7870   -1.8491 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.6513    1.2852    0.1449 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6410    2.0294    1.1751 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.9916    0.7335    0.9946 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6554   -1.6633   -0.5292 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.3971   -1.2295   -0.4704 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6166   -1.7647    1.0276 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.2583   -1.1668    0.0088 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.1618    0.0935    1.3141 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.9674   -1.2161    1.3016 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