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
-3.2042 0.6587 0.5036 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.7220 -0.5805 -0.2266 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.3437 -0.4650 -0.5824 O 0 0 0 0 0 0 0 0 0 0 0 0
-0.3674 -0.2943 0.3772 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.7252 -0.2428 1.5814 O 0 0 0 0 0 0 0 0 0 0 0 0
1.0597 -0.1744 0.0138 C 0 0 0 0 0 0 0 0 0 0 0 0
1.3566 -0.2327 -1.1964 O 0 0 0 0 0 0 0 0 0 0 0 0
2.0433 -0.0052 0.9413 O 0 0 0 0 0 0 0 0 0 0 0 0
3.3709 0.1195 0.7810 C 0 0 0 0 0 0 0 0 0 0 0 0
3.9996 0.1012 -0.3477 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.7170 1.5444 0.0031 H 0 0 0 0 0 0 0 0 0 0 0 0
-4.3064 0.7196 0.4338 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.9027 0.6142 1.5707 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.8905 -1.4724 0.4246 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.2911 -0.7337 -1.1443 H 0 0 0 0 0 0 0 0 0 0 0 0
3.9759 0.2483 1.6886 H 0 0 0 0 0 0 0 0 0 0 0 0
5.1054 0.2105 -0.4066 H 0 0 0 0 0 0 0 0 0 0 0 0
3.5588 -0.0154 -1.3181 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