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
-3.8425 -0.1435 -0.3520 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.6018 0.4801 0.2169 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.4290 -0.1145 -0.3271 O 0 0 0 0 0 0 0 0 0 0 0 0
-0.1896 0.3431 0.0902 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.1577 1.2688 0.9361 O 0 0 0 0 0 0 0 0 0 0 0 0
0.9996 -0.2671 -0.4681 C 0 0 0 0 0 0 0 0 0 0 0 0
0.9505 -1.1945 -1.3154 O 0 0 0 0 0 0 0 0 0 0 0 0
2.2873 0.1426 -0.0944 O 0 0 0 0 0 0 0 0 0 0 0 0
3.4124 -0.4394 -0.6269 C 0 0 0 0 0 0 0 0 0 0 0 0
4.5969 -0.0268 -0.2505 C 0 0 0 0 0 0 0 0 0 0 0 0
-4.2504 0.4405 -1.2175 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.5750 -1.1568 -0.7295 H 0 0 0 0 0 0 0 0 0 0 0 0
-4.6571 -0.2471 0.3725 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.5900 1.5800 0.1152 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.5558 0.2774 1.3260 H 0 0 0 0 0 0 0 0 0 0 0 0
3.3232 -1.2242 -1.3440 H 0 0 0 0 0 0 0 0 0 0 0 0
4.7675 0.7587 0.4671 H 0 0 0 0 0 0 0 0 0 0 0 0
5.5113 -0.4776 -0.6630 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