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
    2.3571    0.7218    0.3723 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.4785   -0.2621   -0.3804 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.1218    0.0003   -0.0127 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9185   -0.7551   -0.5523 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5816   -1.6568   -1.3621 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3073   -0.5144   -0.1998 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6844    0.4232    0.6450 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.2976    0.8952   -0.1919 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.6578    0.3111    1.3601 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.7810    1.6837    0.4932 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.7949   -1.2779   -0.0765 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.6625   -0.0891   -1.4501 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.0807   -1.1192   -0.6381 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8811    1.0342    1.0855 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.6976    0.6051    0.9076 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