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
   -2.2456    0.6314    1.4882 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6446   -0.0774    0.2975 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2828    0.1986    0.1298 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.7273   -0.7406    0.1946 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.3957   -1.9273    0.4204 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.1281   -0.4262    0.0171 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.0380   -1.3700    0.0916 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.5490    0.9617   -0.2501 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4543    0.2354   -0.9435 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0582    1.7095    1.4891 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.3395    0.4469    1.4653 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8638    0.1071    2.3968 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7587   -1.1781    0.4897 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.7565   -2.3948    0.2862 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.0919   -1.1662   -0.0366 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.8863    1.4616   -1.0015 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.4281    1.5849    0.6826 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.5956    1.0485   -0.5742 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1213   -0.4562   -1.7678 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.5241    0.0763   -0.6985 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3034    1.2748   -1.2720 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