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
   -2.3610   -0.9743   -0.6551 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6012   -0.0104    0.2216 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2301   -0.1751    0.1090 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.6209    0.8056   -0.3860 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0895    1.8800   -0.7391 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.0344    0.5299   -0.4605 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.8863    1.4211   -0.9205 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.5903   -0.7796   -0.0182 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1423   -0.1078    1.6127 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1576   -1.9908   -0.2864 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0354   -0.9303   -1.7149 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.4301   -0.6979   -0.6240 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8551    1.0246   -0.1519 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.5040    2.3703   -1.2437 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.9511    1.2503   -0.9911 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.0636   -1.0421    0.9359 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.6730   -0.6950    0.2421 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.4680   -1.5564   -0.7945 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0365    0.8758    2.1561 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.2534   -0.2419    1.5143 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7783   -0.9559    2.1941 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