Monomers

Methacrylic acid

Identifiers

IUPAC name
2-methylprop-2-enoic acid
InchI
InChI=1S/C4H6O2/c1-3(2)4(5)6/h1H2,2H3,(H,5,6)
InchI Key
CERQOIWHTDAKMF-UHFFFAOYSA-N
SMILES
CC(=C)C(=O)O
Canonical SMILES
CC(=C)C(=O)O
Isomeric SMILES
CC(=C)C(=O)O
Resources

Structures

2D Structure
3D Structure

Molecular Formula and Computed Descriptors

Molecular Formula
C4H6O2
Heavy Atom Count
6
Molecular Weight
86.09
Exact Molecular Weight
86.0368
Valence Electrons
34
Radical Electrons
0
tPSA
37.3
MolLogP
0.6471
H Bond Acceptors
1
H Bond Donors
1
Aliphatic Carbocycles
0
Aromatic Carbocycles
0
Aliphatic Heterocycles
0
Aromatic Heterocycles
0
Aliphatic Rings
0
Aromatic Rings
0

MOL File


     RDKit          3D

 12 11  0  0  0  0  0  0  0  0999 V2000
   -1.3296   -0.8200   -0.2746 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1841    0.0560    0.0998 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4441    1.1490    0.7860 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.1881   -0.2774   -0.2773 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.4405   -1.3161   -0.9301 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.2616    0.5244    0.0622 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8189   -0.3692   -1.1433 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0358   -1.8603   -0.4610 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0713   -0.7647    0.5707 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.3845    1.7839    1.0577 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4578    1.3882    1.0603 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.0670    0.5062   -0.5504 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0
  2  3  2  3
  2  4  1  0
  4  5  2  0
  4  6  1  0
  1  7  1  0
  1  8  1  0
  1  9  1  0
  3 10  1  0
  3 11  1  0
  6 12  1  0
M  END

Similar Monomers

Structure
Similarity
IUPAC name
MF
Copolymers