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
   -2.3620    0.3290   -1.2854 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6250   -0.2996   -0.1191 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3065    0.2082   -0.0027 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.7532   -0.6883   -0.0565 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.5133   -1.9070   -0.2049 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.1346   -0.2538    0.0544 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.0930   -1.1537   -0.0043 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4450    1.2078    0.2333 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3584    0.1319    1.1465 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3945   -0.3383   -2.1745 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8625    1.3036   -1.5201 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.4274    0.5452   -1.0378 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6314   -1.3937   -0.2429 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.1122   -0.8068    0.0805 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.8536   -2.1973   -0.1329 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.5870    1.6722    0.7547 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.6832    1.6927   -0.7333 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.3155    1.2456    0.9236 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7694   -0.2872    1.9986 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.3932   -0.2543    1.1799 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3601    1.2438    1.1427 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