Monomers

Ethyl acrylate

Identifiers

IUPAC name
ethyl prop-2-enoate
InchI
InChI=1S/C5H8O2/c1-3-5(6)7-4-2/h3H,1,4H2,2H3
InchI Key
JIGUQPWFLRLWPJ-UHFFFAOYSA-N
SMILES
CCOC(=O)C=C
Canonical SMILES
CCOC(=O)C=C
Isomeric SMILES
CCOC(=O)C=C
Resources

Structures

2D Structure
3D Structure

Molecular Formula and Computed Descriptors

Molecular Formula
C5H8O2
Heavy Atom Count
7
Molecular Weight
100.117
Exact Molecular Weight
100.0524
Valence Electrons
40
Radical Electrons
0
tPSA
26.3
MolLogP
0.7355
H Bond Acceptors
2
H Bond Donors
0
Aliphatic Carbocycles
0
Aromatic Carbocycles
0
Aliphatic Heterocycles
0
Aromatic Heterocycles
0
Aliphatic Rings
0
Aromatic Rings
0

MOL File


     RDKit          3D

 15 14  0  0  0  0  0  0  0  0999 V2000
   -2.6870    0.5742    0.1182 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5419   -0.3414   -0.2565 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3472    0.3088    0.1231 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.8728   -0.2935   -0.0971 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.8893   -1.4188   -0.6365 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.0861    0.3785    0.2941 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.2453   -0.2058    0.0790 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.4702    0.6139   -0.6529 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.0843    0.2087    1.0927 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3182    1.6322    0.2609 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5769   -1.3078    0.2882 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5672   -0.5896   -1.3447 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.0507    1.3580    0.7623 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.1975    0.2587    0.3558 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.2511   -1.1762   -0.3866 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0
  2  3  1  0
  3  4  1  0
  4  5  2  0
  4  6  1  0
  6  7  2  3
  1  8  1  0
  1  9  1  0
  1 10  1  0
  2 11  1  0
  2 12  1  0
  6 13  1  0
  7 14  1  0
  7 15  1  0
M  END

Similar Monomers

Structure
Similarity
IUPAC name
MF
Copolymers