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
3.6474 0.5271 0.5050 C 0 0 0 0 0 0 0 0 0 0 0 0
2.5396 -0.4892 0.3502 C 0 0 0 0 0 0 0 0 0 0 0 0
1.3103 0.1627 0.3571 O 0 0 0 0 0 0 0 0 0 0 0 0
0.1480 -0.6214 0.2230 C 0 0 0 0 0 0 0 0 0 0 0 0
0.2650 -1.8535 0.1049 O 0 0 0 0 0 0 0 0 0 0 0 0
-1.1857 -0.0244 0.2194 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.2476 1.2223 0.3416 O 0 0 0 0 0 0 0 0 0 0 0 0
-2.2707 -0.8377 0.0862 O 0 0 0 0 0 0 0 0 0 0 0 0
-3.5446 -0.4165 0.0678 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.9657 0.8055 0.1704 C 0 0 0 0 0 0 0 0 0 0 0 0
4.6506 0.0150 0.4916 H 0 0 0 0 0 0 0 0 0 0 0 0
3.6193 1.1781 -0.3937 H 0 0 0 0 0 0 0 0 0 0 0 0
3.4980 1.0901 1.4436 H 0 0 0 0 0 0 0 0 0 0 0 0
2.7174 -1.0979 -0.5662 H 0 0 0 0 0 0 0 0 0 0 0 0
2.5874 -1.1966 1.1982 H 0 0 0 0 0 0 0 0 0 0 0 0
-4.3102 -1.2037 -0.0477 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.3942 1.7121 0.2885 H 0 0 0 0 0 0 0 0 0 0 0 0
-5.0643 1.0280 0.1404 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