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
   -1.2606   -0.5759    0.1268 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1061    0.3393   -0.0618 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3292    1.6210   -0.2489 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2498   -0.1830   -0.0385 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.2672    0.5336   -0.1909 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.4426   -1.5364    0.1609 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0436   -0.0723    0.7589 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7059   -0.8730   -0.8277 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9600   -1.4901    0.6677 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.5108    2.2764   -0.3846 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3355    1.9885   -0.2631 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.2705   -2.0282   -0.1941 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