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
3.5042 0.9463 0.1569 C 0 0 0 0 0 0 0 0 0 0 0 0
2.6573 -0.2244 -0.3008 C 0 0 0 0 0 0 0 0 0 0 0 0
1.3093 0.1619 -0.1030 O 0 0 0 0 0 0 0 0 0 0 0 0
0.2444 -0.6668 -0.4137 C 0 0 0 0 0 0 0 0 0 0 0 0
0.5363 -1.8021 -0.8895 O 0 0 0 0 0 0 0 0 0 0 0 0
-1.1397 -0.2416 -0.1988 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.3121 0.8987 0.2757 O 0 0 0 0 0 0 0 0 0 0 0 0
-2.2069 -1.0246 -0.4906 O 0 0 0 0 0 0 0 0 0 0 0 0
-3.5285 -0.7399 -0.3353 C 0 0 0 0 0 0 0 0 0 0 0 0
-4.0191 0.3677 0.1350 C 0 0 0 0 0 0 0 0 0 0 0 0
4.5470 0.6437 0.3833 H 0 0 0 0 0 0 0 0 0 0 0 0
2.9931 1.4097 1.0129 H 0 0 0 0 0 0 0 0 0 0 0 0
3.4694 1.7144 -0.6696 H 0 0 0 0 0 0 0 0 0 0 0 0
2.9466 -1.0933 0.3284 H 0 0 0 0 0 0 0 0 0 0 0 0
2.8581 -0.5027 -1.3549 H 0 0 0 0 0 0 0 0 0 0 0 0
-4.2718 -1.5312 -0.6400 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.4635 1.2141 0.4676 H 0 0 0 0 0 0 0 0 0 0 0 0
-5.1242 0.4700 0.2088 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