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
-3.4582 -0.9701 -0.6944 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.6769 0.0147 0.1535 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.2936 -0.1698 -0.1516 O 0 0 0 0 0 0 0 0 0 0 0 0
-0.3048 0.5687 0.4459 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.5972 1.4322 1.2828 O 0 0 0 0 0 0 0 0 0 0 0 0
1.0966 0.3262 0.0848 C 0 0 0 0 0 0 0 0 0 0 0 0
1.4001 -0.5436 -0.7592 O 0 0 0 0 0 0 0 0 0 0 0 0
2.1305 1.0483 0.6625 O 0 0 0 0 0 0 0 0 0 0 0 0
3.4391 0.7976 0.3025 C 0 0 0 0 0 0 0 0 0 0 0 0
4.2041 -0.0892 0.9189 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.7520 -0.5063 -1.6669 H 0 0 0 0 0 0 0 0 0 0 0 0
-4.3905 -1.3008 -0.1520 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.8516 -1.8695 -0.9583 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.9859 1.0645 -0.0502 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.8755 -0.2182 1.2260 H 0 0 0 0 0 0 0 0 0 0 0 0
3.8509 1.3533 -0.5199 H 0 0 0 0 0 0 0 0 0 0 0 0
3.8394 -0.6768 1.7539 H 0 0 0 0 0 0 0 0 0 0 0 0
5.2256 -0.2611 0.6113 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