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
   -1.4557   -0.5506    0.2051 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1644    0.1578   -0.0372 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1590    1.4700   -0.0082 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.0499   -0.5814   -0.2972 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.0028   -1.8279   -0.3163 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.2607    0.0361   -0.5253 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0409   -0.6600   -0.7151 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0380   -0.0068    0.9775 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2031   -1.5328    0.6259 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.7968    1.9768   -0.1879 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0618    2.0104    0.1849 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.0126   -0.4917   -0.9475 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