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
   -2.4774    0.3030   -0.9445 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6433    0.0711    0.3195 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2884   -0.1536   -0.0082 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.7298    0.6780    0.4377 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.3908    1.6532    1.1555 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.1213    0.4248    0.0857 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.0459    1.2269    0.5231 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.5141   -0.7297   -0.7629 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1991   -1.1799    0.9701 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3092    1.3135   -1.3514 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3396   -0.5006   -1.6803 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.5404    0.2663   -0.5893 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7981    0.9572    0.9522 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.7894    2.0738    1.1415 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.1098    1.1104    0.3072 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.7568   -0.3804   -1.8064 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.4642   -1.2014   -0.3985 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.6949   -1.4616   -0.8793 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5342   -1.8600    0.1394 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4311   -1.6895    1.5952 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.0563   -0.9214    1.6449 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