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
   -2.4324   -1.2656   -0.2492 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4950   -0.3358    0.4714 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4334    0.1204   -0.3049 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.9028   -0.1317    0.0346 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.0585   -0.8003    1.0929 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.0107    0.3356   -0.7617 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.7853    1.0245   -1.8490 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.3883    0.0385   -0.3525 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3463    0.7916    1.0164 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0456   -2.2997   -0.2817 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.3769   -1.2936    0.3469 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7136   -0.8774   -1.2478 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1121   -0.9074    1.3646 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.7919    1.2810   -2.2114 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.6001    1.3995   -2.4845 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.7443   -0.9570   -0.7072 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.1063    0.8463   -0.5927 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.3902   -0.0367    0.7665 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.0336    1.0896    0.1789 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7594    1.6312    1.4028 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.0301    0.3472    1.7909 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