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
-3.6646 0.5091 0.5020 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.6421 -0.0235 -0.4635 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.3387 0.0601 0.1344 O 0 0 0 0 0 0 0 0 0 0 0 0
-0.2151 -0.3582 -0.5261 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.3557 -0.8239 -1.6858 O 0 0 0 0 0 0 0 0 0 0 0 0
1.1147 -0.2636 0.1059 C 0 0 0 0 0 0 0 0 0 0 0 0
1.2561 0.2014 1.2642 O 0 0 0 0 0 0 0 0 0 0 0 0
2.2560 -0.6841 -0.5545 O 0 0 0 0 0 0 0 0 0 0 0 0
3.5184 -0.6059 0.0181 C 0 0 0 0 0 0 0 0 0 0 0 0
4.3099 0.4238 -0.0922 C 0 0 0 0 0 0 0 0 0 0 0 0
-4.5800 0.8926 -0.0100 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.9876 -0.2998 1.2116 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.2585 1.3494 1.0942 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.8972 -1.1082 -0.6278 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.6674 0.4516 -1.4477 H 0 0 0 0 0 0 0 0 0 0 0 0
3.8503 -1.4605 0.5874 H 0 0 0 0 0 0 0 0 0 0 0 0
5.2778 0.4156 0.3795 H 0 0 0 0 0 0 0 0 0 0 0 0
4.0238 1.3240 -0.6612 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