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
   -2.4442   -0.9692   -0.6501 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5872   -0.1643    0.2689 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2895    0.0467   -0.1801 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.8636   -0.3810    0.4635 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.6933   -1.0092    1.5402 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.1997   -0.1144   -0.0825 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.2968   -0.5108    0.5117 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.2933    0.6364   -1.3615 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3248    1.1391    0.5644 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2971   -2.0559   -0.5884 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3847   -0.5985   -1.7088 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.5118   -0.7875   -0.3524 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5178   -0.7386    1.2373 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.3128   -1.0629    1.4464 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.2662   -0.2993    0.0849 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.3900    1.2442   -1.5521 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.4763   -0.1177   -2.1616 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.1455    1.3679   -1.3341 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.4310    1.0094    0.4512 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0168    1.8799   -0.1993 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1325    1.4860    1.5988 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