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
3.2667 0.1936 0.1718 C 0 0 0 0 0 0 0 0 0 0 0 0
2.5647 0.8097 -1.0152 C 0 0 0 0 0 0 0 0 0 0 0 0
1.2924 0.2175 -1.1792 O 0 0 0 0 0 0 0 0 0 0 0 0
0.3201 0.2688 -0.1976 C 0 0 0 0 0 0 0 0 0 0 0 0
0.5564 0.8564 0.8823 O 0 0 0 0 0 0 0 0 0 0 0 0
-0.9554 -0.3797 -0.4826 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.1788 -0.9658 -1.5706 O 0 0 0 0 0 0 0 0 0 0 0 0
-1.9889 -0.3806 0.4392 O 0 0 0 0 0 0 0 0 0 0 0 0
-3.1736 -1.0137 0.1069 C 0 0 0 0 0 0 0 0 0 0 0 0
-4.1080 -0.3004 -0.4948 C 0 0 0 0 0 0 0 0 0 0 0 0
3.0745 -0.9124 0.1440 H 0 0 0 0 0 0 0 0 0 0 0 0
4.3617 0.3926 0.0902 H 0 0 0 0 0 0 0 0 0 0 0 0
2.8801 0.6614 1.0798 H 0 0 0 0 0 0 0 0 0 0 0 0
2.3755 1.9050 -0.8444 H 0 0 0 0 0 0 0 0 0 0 0 0
3.1534 0.6571 -1.9364 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.3921 -2.0486 0.3029 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.9793 0.7559 -0.7354 H 0 0 0 0 0 0 0 0 0 0 0 0
-5.0696 -0.7166 -0.7919 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