Monomers

Isobutyl methacrylate

Identifiers

IUPAC name
2-methylpropyl 2-methylprop-2-enoate
InchI
InChI=1S/C8H14O2/c1-6(2)5-10-8(9)7(3)4/h6H,3,5H2,1-2,4H3
InchI Key
RUMACXVDVNRZJZ-UHFFFAOYSA-N
SMILES
CC(COC(=O)C(=C)C)C
Canonical SMILES
CC(C)COC(=O)C(=C)C
Isomeric SMILES
CC(C)COC(=O)C(=C)C
Resources
cid=

Structures

2D Structure
3D Structure

Molecular Formula and Computed Descriptors

Molecular Formula
C8H14O2
Heavy Atom Count
10
Molecular Weight
142.198
Exact Molecular Weight
142.0994
Valence Electrons
58
Radical Electrons
0
tPSA
26.3
MolLogP
1.7617
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

 24 23  0  0  0  0  0  0  0  0999 V2000
   -3.1572    0.8653   -0.6243 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8234    0.1307   -0.4261 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9050    1.1600    0.2449 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.3669    0.6548    0.5020 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.2267    0.1820   -0.4708 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.8126    0.2209   -1.6512 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.5447   -0.3365   -0.1594 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.3277   -0.7760   -1.1238 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.0644   -0.3948    1.2389 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0427   -1.0516    0.4952 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.6459    0.9880    0.3586 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.7873    0.3497   -1.3696 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8734    1.9034   -0.9586 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4824   -0.1498   -1.4209 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3995    1.3576    1.2395 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9258    2.1071   -0.2938 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.9704   -0.7417   -2.1363 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.3050   -1.1600   -0.8891 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.3415   -0.0042    1.9697 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.0056    0.2026    1.2491 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.3415   -1.4328    1.5038 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.1233   -1.2410    0.6837 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5286   -0.8436    1.4586 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6129   -1.9898    0.0823 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  1  0
  5  6  2  0
  5  7  1  0
  7  8  2  3
  7  9  1  0
  2 10  1  0
  1 11  1  0
  1 12  1  0
  1 13  1  0
  2 14  1  0
  3 15  1  0
  3 16  1  0
  8 17  1  0
  8 18  1  0
  9 19  1  0
  9 20  1  0
  9 21  1  0
 10 22  1  0
 10 23  1  0
 10 24  1  0
M  END

Similar Monomers

Structure
Similarity
IUPAC name
MF
Copolymers