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
   -0.3367   -2.1031    1.7381 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7029   -1.4455    0.4450 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.1478   -0.4187    0.0547 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2415    0.9120   -0.1219 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4337    1.1846    0.0874 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.7503    1.8889   -0.5335 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.9973    1.5586   -0.7435 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.3290    3.2929   -0.7175 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8693   -2.5202   -0.6177 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.5489   -2.7645    1.6603 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2573   -1.3640    2.5564 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1892   -2.7860    2.0106 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7287   -1.0082    0.5852 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.7045    2.3131   -1.0484 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.3797    0.5419   -0.6274 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.9200    3.6905   -1.5900 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7337    3.3825   -1.0247 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.5748    3.9194    0.1603 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.0148   -3.1468   -0.7397 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7963   -3.0899   -0.3813 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0779   -2.0375   -1.6134 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