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
   -2.1992    0.2312   -0.3139 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3340   -1.0165   -0.1447 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0074   -0.6970   -0.4565 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.6484    0.2913    0.2942 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0018    0.8420    1.2051 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.0312    0.6778    0.0342 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.7347    0.0930   -0.9394 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.2072   -0.0566   -0.6730 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6655    0.8946   -1.0022 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2770    0.7224    0.6853 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4218   -1.3943    0.8992 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7599   -1.7804   -0.7956 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.4563    1.4486    0.6563 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.7368    0.4170   -1.0806 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.2517   -0.6731   -1.5281 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