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
    2.2741    1.0423    0.7862 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.6144   -0.1200    0.0733 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.2715    0.1294   -0.0369 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7056   -0.6142    0.5974 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2811   -1.5488    1.2931 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1402   -0.3209    0.4590 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.9931   -1.0857    1.1019 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6078    0.7905   -0.3705 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.3802   -0.3986   -1.1718 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.1004    0.6628    1.4528 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.5228    1.4989    1.4446 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.6997    1.7833    0.0585 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.7538   -1.0112    0.7529 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6882   -1.9206    1.7279 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.0461   -0.8807    1.0083 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8330    1.5866   -0.3949 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.5288    1.2721    0.0370 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7902    0.4814   -1.4101 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.3233   -1.4386   -1.5291 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.4706   -0.2630   -0.8966 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.2031    0.3553   -1.9646 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