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
    2.3147   -1.4010    0.1760 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.5752   -0.1023    0.3701 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.3464   -0.0731   -0.3097 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8222    0.1099    0.4033 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7883    0.2494    1.6506 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1369    0.1528   -0.2221 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.2479    0.3253    0.4424 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1807   -0.0130   -1.7061 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.3801    1.0894   -0.0950 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.6115   -2.2010   -0.1237 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.0335   -1.2975   -0.6770 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.8767   -1.6290    1.0956 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.4012    0.0365    1.4548 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.2790    0.4497    1.5080 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.1868    0.3466   -0.0856 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2333   -0.4212   -2.1027 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4401    0.9773   -2.1355 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.0186   -0.7137   -1.9839 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.3122    1.9470    0.5842 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.0498    1.4447   -1.1030 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.4323    0.7233   -0.2391 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