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
   -2.4941    0.9139    0.2385 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6128   -0.2242   -0.2335 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2543    0.1273   -0.2295 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.6995   -0.4915    0.5854 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.2527   -1.4060    1.3338 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.0878   -0.1026    0.5616 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.9434   -0.7203    1.3516 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.5008    0.9885   -0.3609 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0703   -0.7634   -1.5704 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.4358    0.4671    0.6152 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9411    1.4902    0.9772 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7711    1.5975   -0.5905 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7336   -1.0448    0.5067 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.6114   -1.4937    1.9958 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.9870   -0.3865    1.2947 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.5801    0.8269   -0.5720 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.3853    1.9963    0.0934 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.9152    0.9032   -1.3172 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6105   -0.2230   -2.4199 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.1717   -0.6181   -1.6802 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8681   -1.8368   -1.6609 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