Monomers

Vinyl ethyl oxalate

Identifiers

IUPAC name
2-O-ethenyl 1-O-ethyl oxalate
InchI
InChI=1S/C6H8O4/c1-3-9-5(7)6(8)10-4-2/h3H,1,4H2,2H3
InchI Key
VWBJUKIWBKFFCF-UHFFFAOYSA-N
SMILES
CCOC(=O)C(=O)OC=C
Canonical SMILES
CCOC(=O)C(=O)OC=C
Isomeric SMILES
CCOC(=O)C(=O)OC=C
Resources
cid=

Structures

2D Structure
3D Structure

Molecular Formula and Computed Descriptors

Molecular Formula
C6H8O4
Heavy Atom Count
10
Molecular Weight
144.126
Exact Molecular Weight
144.0423
Valence Electrons
56
Radical Electrons
0
tPSA
52.6
MolLogP
0.2362
H Bond Acceptors
4
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

 18 17  0  0  0  0  0  0  0  0999 V2000
   -3.6998   -1.0086    0.0878 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6854    0.0658   -0.2392 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3744   -0.3920    0.1029 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2576    0.3971   -0.0939 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4354    1.5350   -0.5858 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.0586   -0.1120    0.2700 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.1813   -1.2622    0.7604 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.2168    0.6318    0.0970 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.4638    0.1228    0.4529 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.5040    0.9081    0.2491 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.2293   -1.6990    0.8028 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.6362   -0.5373    0.5073 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.0217   -1.4896   -0.8572 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6844    0.3380   -1.3143 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8801    0.9382    0.4180 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.5625   -0.8629    0.8722 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.4752    0.5279    0.5195 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.4420    1.8989   -0.1680 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  0
  6  8  1  0
  8  9  1  0
  9 10  2  3
  1 11  1  0
  1 12  1  0
  1 13  1  0
  2 14  1  0
  2 15  1  0
  9 16  1  0
 10 17  1  0
 10 18  1  0
M  END

Similar Monomers

Structure
Similarity
IUPAC name
MF
Copolymers