| CAS Number | 84565-26-4 |
| Catalog Number | AG00IDEA(AGN-PC-0OJ77S) |
| Chemical Name | 6-Oxaspiro[3.4]octan-5-one |
| IUPAC Name | 6-oxaspiro[3.4]octan-5-one |
| InChI | InChI=1S/C7H10O2/c8-6-7(2-1-3-7)4-5-9-6/h1-5H2 |
| InChI Key | AMXISTVVYIIGOD-UHFFFAOYSA-N |
| MDL Number | MFCD26936294 |
| Molecular Formula | C7H10O2 |
| Molecular Weight | 126.1531 |
| SMILES | O=C(OCC1)C21CCC2 |
| Synonyms | 6-Oxaspiro[3.4]octan-5-one,
84565-26-4,
SCHEMBL19745505,
MFCD26936294,
ZINC95883772,
AKOS027338630,
MCULE-6969824787,
AS-32969,
Z1723549427,
|
| Complexity | 147 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 126.068g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 9 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 126.155g/mol |
| Monoisotopic Mass | 126.068g/mol |
| Rotatable Bond Count | 0 |
| Topological Polar Surface Area | 26.3A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1.1 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number