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
   -2.2237   -1.4461   -0.3905 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5966   -0.3302    0.4353 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3229    0.0195   -0.0522 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.7840   -0.0702    0.7759 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.5712   -0.4731    1.9528 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.1242    0.2653    0.3663 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.1122    0.1466    1.2282 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4704    0.7470   -0.9956 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5533    0.8418    0.3672 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9000   -1.3338   -1.4506 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.3359   -1.3648   -0.3794 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9750   -2.4465    0.0127 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5254   -0.6499    1.4871 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.1438    0.3876    0.9677 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.9125   -0.2038    2.2446 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.4107    1.3333   -0.9756 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.6467   -0.1438   -1.6304 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.6941    1.4094   -1.4176 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0428    1.8187    0.4906 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.0756    0.8176   -0.6264 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.3185    0.6754    1.1532 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