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
   -1.4748   -0.5320   -0.2715 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1591    0.1156   -0.1069 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0202    1.3618   -0.5055 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.9929   -0.5478    0.4717 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.8916   -1.7374    0.8616 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.2263    0.0605    0.6256 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5144   -1.2132   -1.1515 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7460   -1.1346    0.6367 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2619    0.2165   -0.3890 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.9390    1.8410   -0.3880 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8592    1.8949   -0.9446 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.9859   -0.3252    1.1614 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