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
cid=

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
   -1.0041   -0.9550   -0.3127 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2231    0.2343    0.1130 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8293    1.3235    0.4863 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2141    0.1706    0.1086 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.8874    1.1659    0.4651 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.9257   -0.9614   -0.2784 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3833   -1.8627   -0.2027 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3514   -0.8837   -1.3480 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8780   -1.0134    0.3849 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9075    1.3798    0.4925 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2780    2.1966    0.7985 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.8275   -0.7945   -0.7071 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