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
    2.1077    0.9686    1.3263 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.6348   -0.0758    0.3418 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.2999    0.2452   -0.0258 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7171   -0.6300    0.3143 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4160   -1.6760    0.9364 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0969   -0.3958   -0.0116 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.0074   -1.2579    0.3364 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4624    0.8275   -0.7411 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.5352   -0.1745   -0.8589 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.2275    0.9523    1.3679 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.7541    0.7662    2.3547 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.7611    1.9809    1.0028 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.6696   -1.0529    0.8877 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.0384   -1.0743    0.0881 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7803   -2.1677    0.8725 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.5109    0.7757   -1.1540 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4826    1.7202   -0.0580 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7386    1.0447   -1.5786 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.8834   -0.3160   -1.7704 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.1443   -1.1168   -0.8165 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.2331    0.6564   -0.9690 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