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
   -2.2287    1.0489   -1.1314 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6856   -0.0612   -0.2362 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3415    0.2601    0.0711 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.7365   -0.5185   -0.2923 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.4949   -1.5718   -0.9334 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.1180   -0.1695    0.0346 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.1006   -0.9589   -0.3435 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4655    1.0608    0.7893 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4983   -0.0588    1.0253 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5679    1.0348   -2.0362 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1058    2.0327   -0.6715 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.2613    0.8407   -1.4565 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7860   -1.0013   -0.7982 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.1427   -0.7356   -0.1205 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.8656   -1.8579   -0.8933 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.3479    0.8243    1.4199 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.7802    1.8359    0.0560 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.6083    1.4231    1.3933 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.2899    0.7266    1.0296 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.0202   -1.0259    1.1707 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8751    0.1372    1.9231 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