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
    2.4423    0.2792    1.0010 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.6159   -0.1808   -0.1877 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.2581    0.0875    0.0029 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7512   -0.8264    0.0279 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4658   -2.0284   -0.1321 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1155   -0.4054    0.2352 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.0783   -1.3230    0.2542 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3958    1.0377    0.4200 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.1864    0.4918   -1.4089 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.3763   -0.4219    1.8559 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.0655    1.2672    1.3638 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.5081    0.3867    0.7128 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.7097   -1.2804   -0.3141 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.0824   -0.9782    0.4104 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8574   -2.3599    0.1191 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.3697    1.2371   -0.1163 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4827    1.3103    1.4856 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6517    1.6752   -0.0975 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.3233    1.5838   -1.2528 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.5750    0.3690   -2.3070 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.1901    0.0791   -1.6157 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