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
-3.6403 0.3576 -0.4153 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.4597 0.9634 0.3221 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.3327 0.1782 -0.0427 O 0 0 0 0 0 0 0 0 0 0 0 0
-0.0689 0.4199 0.4279 C 0 0 0 0 0 0 0 0 0 0 0 0
0.0555 1.4066 1.2289 O 0 0 0 0 0 0 0 0 0 0 0 0
1.0613 -0.3994 0.0372 C 0 0 0 0 0 0 0 0 0 0 0 0
0.8551 -1.3520 -0.7553 O 0 0 0 0 0 0 0 0 0 0 0 0
2.3468 -0.2019 0.4778 O 0 0 0 0 0 0 0 0 0 0 0 0
3.3826 -1.0289 0.0601 C 0 0 0 0 0 0 0 0 0 0 0 0
4.0919 -0.7387 -1.0370 C 0 0 0 0 0 0 0 0 0 0 0 0
-4.4754 1.0834 -0.4666 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.9406 -0.5557 0.1612 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.2640 0.0758 -1.4227 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.3585 2.0193 -0.0084 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.6539 0.9119 1.4205 H 0 0 0 0 0 0 0 0 0 0 0 0
3.6590 -1.9283 0.5914 H 0 0 0 0 0 0 0 0 0 0 0 0
3.8484 0.1452 -1.5918 H 0 0 0 0 0 0 0 0 0 0 0 0
4.8932 -1.3565 -1.3811 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