Monomers

Ethyl 2-ethoxyprop-2-enoate

Identifiers

IUPAC name
ethyl 2-ethoxyprop-2-enoate
InchI
InChI=1S/C7H12O3/c1-4-9-6(3)7(8)10-5-2/h3-5H2,1-2H3
InchI Key
WXMSGMOIAQWILS-UHFFFAOYSA-N
SMILES
CCOC(=O)C(=C)OCC
Canonical SMILES
CCOC(=C)C(=O)OCC
Isomeric SMILES
CCOC(=C)C(=O)OCC
Resources
cid=

Structures

2D Structure
3D Structure

Molecular Formula and Computed Descriptors

Molecular Formula
C7H12O3
Heavy Atom Count
10
Molecular Weight
144.17
Exact Molecular Weight
144.0786
Valence Electrons
58
Radical Electrons
0
tPSA
35.53
MolLogP
1.0997
H Bond Acceptors
3
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

 22 21  0  0  0  0  0  0  0  0999 V2000
    3.6711    0.8041    0.0677 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.0669   -0.2552    0.9603 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.8779   -0.7838    0.4495 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.7372   -0.0458    0.1851 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.7914    1.1870    0.4274 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4831   -0.6388   -0.3482 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5702   -1.9200   -0.6107 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5846    0.1604   -0.5878 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8065    0.0205    0.1136 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.7929    1.0410   -0.3885 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.9638    1.1478   -0.6926 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.5380    0.3507   -0.4644 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.0264    1.6905    0.6314 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.7666   -1.1036    1.1305 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.9308    0.2185    1.9756 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.2252   -2.6383   -0.4633 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4942   -2.3048   -1.0029 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.1466   -1.0197   -0.0377 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6055    0.2017    1.1983 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.7607    0.5460   -0.6032 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.3883    1.5311   -1.2935 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.9629    1.8106    0.3915 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
  6  8  1  0
  8  9  1  0
  9 10  1  0
  1 11  1  0
  1 12  1  0
  1 13  1  0
  2 14  1  0
  2 15  1  0
  7 16  1  0
  7 17  1  0
  9 18  1  0
  9 19  1  0
 10 20  1  0
 10 21  1  0
 10 22  1  0
M  END

Similar Monomers

Structure
Similarity
IUPAC name
MF
Copolymers