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
-3.3350 0.0442 0.2979 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.7016 0.1977 -1.0627 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.3787 -0.2561 -1.1175 O 0 0 0 0 0 0 0 0 0 0 0 0
-0.3337 0.2183 -0.3705 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.5569 1.1448 0.4452 O 0 0 0 0 0 0 0 0 0 0 0 0
1.0170 -0.3326 -0.5096 C 0 0 0 0 0 0 0 0 0 0 0 0
1.2262 -1.2615 -1.3316 O 0 0 0 0 0 0 0 0 0 0 0 0
2.0612 0.1639 0.2582 O 0 0 0 0 0 0 0 0 0 0 0 0
3.3370 -0.3583 0.1251 C 0 0 0 0 0 0 0 0 0 0 0 0
4.3199 0.1178 0.8560 C 0 0 0 0 0 0 0 0 0 0 0 0
-4.3173 -0.5083 0.2347 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.5986 1.0379 0.7212 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.6926 -0.5286 1.0057 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.7963 1.2563 -1.4394 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.2922 -0.4406 -1.7723 H 0 0 0 0 0 0 0 0 0 0 0 0
3.5850 -1.1610 -0.5660 H 0 0 0 0 0 0 0 0 0 0 0 0
4.1185 0.9104 1.5508 H 0 0 0 0 0 0 0 0 0 0 0 0
5.3380 -0.2443 0.8016 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