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
   -2.2354    1.4021    0.0719 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6726   -0.0014    0.2781 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3306    0.0564   -0.1074 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.7285   -0.2192    0.7759 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.4011   -0.5198    1.9291 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.0782   -0.1313    0.2779 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.3401    0.1983   -0.9742 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.1861   -0.4309    1.2441 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4996   -0.9396   -0.5639 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.3295    1.3762   -0.0940 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7891    1.7632   -0.8852 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9222    2.0905    0.8677 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8086   -0.2852    1.3445 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.5128    0.4035   -1.6271 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.3266    0.2728   -1.3763 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.0874   -0.6535    0.6323 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.3292    0.4193    1.9233 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.8991   -1.3731    1.7456 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.5642   -0.5844   -0.4698 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4903   -1.9723   -0.1915 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2471   -0.8714   -1.6231 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