| CAS Number | 42564-36-3 |
| Catalog Number | AG019Z6I(AGN-PC-0WBNTN) |
| Chemical Name | ethyl 2-oxo-2-(2-oxooxolan-3-yl)acetate |
| IUPAC Name | ethyl 2-oxo-2-(2-oxooxolan-3-yl)acetate |
| InChI | InChI=1S/C8H10O5/c1-2-12-8(11)6(9)5-3-4-13-7(5)10/h5H,2-4H2,1H3 |
| InChI Key | UBJLUTQBSGFTBU-UHFFFAOYSA-N |
| MDL Number | MFCD00030632 |
| Molecular Formula | C8H10O5 |
| Molecular Weight | 186.1620 |
| SMILES | CCOC(C(C1C(=O)OCC1)=O)=O |
| Synonyms | 42564-36-3,
Ethyl 2-oxo-2-(2-oxooxolan-3-yl)acetate,
OXO-(2-OXO-TETRAHYDRO-FURAN-3-YL)-ACETIC ACID ETHYL ESTER,
oxo-(2-oxotetrahydrofuran-3-yl)acetic acid ethyl ester,
SCHEMBL8197881,
UBJLUTQBSGFTBU-UHFFFAOYSA-N,
4446AJ,
MFCD00030632,
AKOS015908168,
ethyl (tetrahydro-2-oxo-3-furyl)glyoxylate,
ethyl oxo(2-oxotetrahydro-3-furanyl)acetate,
ethyl (tetrahydro-2-oxo-3-furyl)-glyoxylate,
Ethyl 2-Oxo-2-(2-oxotetrahydrofuran-3-yl)acetate,
alpha,2-Dioxotetrahydrofuran-3-acetic acid ethyl ester,
C8H10O5,
CID10607581,
|
| Complexity | 245 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 186.053g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 13 |
| Hydrogen Bond Acceptor Count | 5 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 186.163g/mol |
| Monoisotopic Mass | 186.053g/mol |
| Rotatable Bond Count | 4 |
| Topological Polar Surface Area | 69.7A^2 |
| Undefined Atom Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 0.6 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number