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
-3.0920 0.0523 0.5152 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.7761 0.0818 -0.9451 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.4152 0.4771 -1.1659 O 0 0 0 0 0 0 0 0 0 0 0 0
-0.3750 -0.2805 -0.6337 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.7097 -1.2957 0.0279 O 0 0 0 0 0 0 0 0 0 0 0 0
1.0208 0.0686 -0.8229 C 0 0 0 0 0 0 0 0 0 0 0 0
1.3822 1.0684 -1.4734 O 0 0 0 0 0 0 0 0 0 0 0 0
2.0011 -0.7278 -0.2669 O 0 0 0 0 0 0 0 0 0 0 0 0
3.3376 -0.3936 -0.4481 C 0 0 0 0 0 0 0 0 0 0 0 0
4.0138 0.3741 0.3516 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.9174 0.7624 0.7270 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.4154 -0.9639 0.8282 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.2332 0.3628 1.1297 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.4433 0.7412 -1.5063 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.8731 -0.9425 -1.3645 H 0 0 0 0 0 0 0 0 0 0 0 0
3.8246 -0.8121 -1.3184 H 0 0 0 0 0 0 0 0 0 0 0 0
3.6213 0.8425 1.2481 H 0 0 0 0 0 0 0 0 0 0 0 0
5.0492 0.5848 0.1394 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