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
   -2.1506    0.4040    0.4234 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4941    0.5718   -0.9180 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1230    0.8034   -0.7992 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.6686   -0.1605   -0.1763 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0945   -1.1975    0.2487 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.1027    0.0141   -0.0179 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.7929   -0.9180    0.5714 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.9653    1.1538    0.6004 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6050   -0.6002    0.5090 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4032    0.5199    1.2596 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7065   -0.3131   -1.5393 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9777    1.4339   -1.4164 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.6023    0.8961   -0.3773 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.8534   -0.8083    0.6984 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.3111   -1.7993    0.9335 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