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
-3.6998 0.3095 -0.4750 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.5955 -0.1968 0.4036 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.3068 0.0597 -0.1457 O 0 0 0 0 0 0 0 0 0 0 0 0
-0.2099 -0.3637 0.5791 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.3778 -0.9515 1.6807 O 0 0 0 0 0 0 0 0 0 0 0 0
1.1575 -0.1558 0.1158 C 0 0 0 0 0 0 0 0 0 0 0 0
1.3989 0.4249 -0.9767 O 0 0 0 0 0 0 0 0 0 0 0 0
2.2460 -0.5879 0.8568 O 0 0 0 0 0 0 0 0 0 0 0 0
3.5616 -0.4186 0.4679 C 0 0 0 0 0 0 0 0 0 0 0 0
4.2017 0.6716 0.8326 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.2697 0.7044 -1.4373 H 0 0 0 0 0 0 0 0 0 0 0 0
-4.4628 -0.4891 -0.6966 H 0 0 0 0 0 0 0 0 0 0 0 0
-4.2434 1.1303 0.0308 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.6731 -1.3151 0.4702 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.6831 0.1656 1.4438 H 0 0 0 0 0 0 0 0 0 0 0 0
4.0146 -1.1972 -0.1260 H 0 0 0 0 0 0 0 0 0 0 0 0
5.2501 0.8049 0.5218 H 0 0 0 0 0 0 0 0 0 0 0 0
3.6914 1.4047 1.4224 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