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
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
-3.7297 -0.4611 -0.1286 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.5613 0.3784 -0.5123 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.3216 -0.1827 -0.0640 O 0 0 0 0 0 0 0 0 0 0 0 0
-0.1425 0.4767 -0.3408 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.2122 1.5498 -0.9799 O 0 0 0 0 0 0 0 0 0 0 0 0
1.1688 -0.0318 0.0833 C 0 0 0 0 0 0 0 0 0 0 0 0
1.2877 -1.0967 0.7223 O 0 0 0 0 0 0 0 0 0 0 0 0
2.2922 0.6884 -0.2347 O 0 0 0 0 0 0 0 0 0 0 0 0
3.5894 0.4179 0.0477 C 0 0 0 0 0 0 0 0 0 0 0 0
4.0454 -0.6149 0.6996 C 0 0 0 0 0 0 0 0 0 0 0 0
-4.0652 -0.1509 0.8791 H 0 0 0 0 0 0 0 0 0 0 0 0
-4.5700 -0.2477 -0.8247 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.5443 -1.5479 -0.1943 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.6957 1.3879 -0.0451 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.4779 0.4303 -1.6154 H 0 0 0 0 0 0 0 0 0 0 0 0
4.3415 1.1437 -0.3087 H 0 0 0 0 0 0 0 0 0 0 0 0
5.1382 -0.7157 0.8626 H 0 0 0 0 0 0 0 0 0 0 0 0
3.4569 -1.4239 1.1206 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