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
    1.5636   -0.1031    0.2917 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.1217   -0.2351   -0.0580 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3574   -1.2441   -0.7297 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7940    0.8092    0.3691 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3997    1.8089    1.0192 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1558    0.7342    0.0674 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.7034    0.3919    1.2730 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.1190   -1.0433    0.1909 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.0039    0.6033   -0.4632 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3961   -1.3004   -0.9593 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.3120   -2.0170   -1.0474 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7206    1.5955    0.0465 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