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
    1.6360    2.0808   -0.5139 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.8950    1.2871    0.5388 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0167    0.3392   -0.0140 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.1096   -1.0125    0.1418 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.0807   -1.4433    0.8522 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8183   -1.9731   -0.4449 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6532   -3.2716   -0.2420 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9461   -1.4840   -1.2692 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.2067    2.1977    1.5343 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.1019    3.0074   -0.8083 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.6008    2.3955   -0.0669 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.8372    1.4019   -1.3626 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.6613    0.7201    1.1146 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3118   -4.0196   -0.6541 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.1724   -3.6276    0.3612 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3243   -2.2615   -1.9773 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6548   -0.6024   -1.9001 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7637   -1.1069   -0.6015 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6210    1.7050    2.0532 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.9185    2.5678    2.3057 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1437    3.1003    0.9529 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