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
   -2.3453   -0.7118    1.2131 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6378    0.1007    0.1566 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3066   -0.2500   -0.0274 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.7177    0.6575    0.1808 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.3882    1.8117    0.5434 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.1236    0.3490    0.0048 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.0297    1.2806    0.2272 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.5151   -1.0098   -0.4224 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3635    0.0157   -1.1714 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.4036   -0.3749    1.2215 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3256   -1.8024    0.9802 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9197   -0.4592    2.1867 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6855    1.1621    0.4748 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.0908    1.0779    0.1033 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.7816    2.2848    0.5404 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.5637   -0.9511   -0.8143 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.5135   -1.7409    0.4082 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.8975   -1.4039   -1.2466 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0264   -0.8762   -1.7401 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1338    0.8918   -1.8208 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.4735   -0.0515   -0.9981 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