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
   -0.5935    0.8707   -0.9580 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3104   -0.0776    0.1386 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2807   -0.5735    0.8644 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.0614   -0.4387    0.3840 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.3068   -1.2415    1.3115 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.1252    0.0544   -0.3512 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.2251    0.8490   -1.7070 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6946    1.8825   -0.4791 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5387    0.5541   -1.4354 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3288   -0.3325    0.7186 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0482   -1.2773    1.6752 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.0763   -0.2695   -0.1615 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