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
   -2.4796   -0.5219    0.8367 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6169   -0.0500   -0.3369 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2547   -0.2895   -0.0414 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.5840    0.7888    0.0406 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.1351    1.9410   -0.1444 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.9915    0.6397    0.3379 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.7604    1.7025    0.4070 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.5419   -0.7134    0.5598 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9646   -0.8093   -1.5740 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5745   -1.6166    0.8529 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9733   -0.1328    1.7476 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.4851   -0.1046    0.6971 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8409    1.0206   -0.4697 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.4148    2.7107    0.2548 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.8071    1.5811    0.6290 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.6314   -0.6767    0.3377 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.3413   -1.0696    1.5893 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.1201   -1.4727   -0.1393 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0518   -0.8952   -2.2014 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7360   -0.2258   -2.1241 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3503   -1.8065   -1.2591 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