Monomers

Acrylic acid

Identifiers

IUPAC name
prop-2-enoic acid
InchI
InChI=1S/C3H4O2/c1-2-3(4)5/h2H,1H2,(H,4,5)
InchI Key
NIXOWILDQLNWCW-UHFFFAOYSA-N
SMILES
OC(=O)C=C
Canonical SMILES
C=CC(=O)O
Isomeric SMILES
C=CC(=O)O
Resources

Structures

2D Structure
3D Structure

Molecular Formula and Computed Descriptors

Molecular Formula
C3H4O2
Heavy Atom Count
5
Molecular Weight
72.063
Exact Molecular Weight
72.0211
Valence Electrons
28
Radical Electrons
0
tPSA
37.3
MolLogP
0.257
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

  9  8  0  0  0  0  0  0  0  0999 V2000
    1.5388    0.5732   -0.2099 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.8037   -0.5319    0.2179 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.4242   -1.5234    0.6617 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6485   -0.4902    0.1322 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2722    0.5727   -0.3417 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4437    0.7469    0.2396 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1890   -1.3593    0.4704 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3512    0.5754   -0.3935 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7496    1.4365   -0.6785 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0
  2  3  2  0
  2  4  1  0
  4  5  2  3
  1  6  1  0
  4  7  1  0
  5  8  1  0
  5  9  1  0
M  END

Similar Monomers

Structure
Similarity
IUPAC name
MF
Copolymers