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
-3.2213 0.4037 -0.4699 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.7337 -0.8226 0.2915 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.3961 -1.1217 0.0281 O 0 0 0 0 0 0 0 0 0 0 0 0
-0.4003 -0.2264 0.3018 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.6921 0.8897 0.8009 O 0 0 0 0 0 0 0 0 0 0 0 0
1.0151 -0.4931 0.0440 C 0 0 0 0 0 0 0 0 0 0 0 0
1.2925 -1.6221 -0.4590 O 0 0 0 0 0 0 0 0 0 0 0 0
2.0081 0.4204 0.3257 O 0 0 0 0 0 0 0 0 0 0 0 0
3.3178 0.0956 0.0543 C 0 0 0 0 0 0 0 0 0 0 0 0
4.2829 0.9510 0.3145 C 0 0 0 0 0 0 0 0 0 0 0 0
-4.3376 0.4073 -0.4517 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.8392 1.3359 -0.0093 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.9421 0.2989 -1.5383 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.8633 -0.6492 1.3863 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.4172 -1.6460 0.0249 H 0 0 0 0 0 0 0 0 0 0 0 0
3.5684 -0.8765 -0.3800 H 0 0 0 0 0 0 0 0 0 0 0 0
4.0343 1.9070 0.7419 H 0 0 0 0 0 0 0 0 0 0 0 0
5.3239 0.7479 0.1220 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