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
   -2.5099   -0.1049   -0.9866 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6402   -0.2986    0.2355 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3069    0.1127    0.0066 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.7725   -0.7544    0.1263 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.5256   -1.9233    0.4463 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.1449   -0.2672   -0.1255 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.1261   -1.1221    0.0002 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.3876    1.1474   -0.5075 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1752    0.5732    1.3574 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8463    0.2160   -1.8154 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.0369   -1.0294   -1.2900 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.2772    0.6659   -0.8149 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7193   -1.3690    0.5150 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.9266   -2.1374    0.2767 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.1259   -0.7859   -0.1785 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.8282    1.4689   -1.3883 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.1636    1.8500    0.3323 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.4677    1.2660   -0.7168 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7614    1.6041    1.2966 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.2848    0.7003    1.2375 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9105    0.1876    2.3589 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