| CAS Number | 1159280-53-1 |
| Catalog Number | AG000H3Z(AGN-PC-0I5O8A) |
| Chemical Name | 3-oxaspiro[5.5]undecan-9-one |
| IUPAC Name | 3-oxaspiro[5.5]undecan-9-one |
| InChI | InChI=1S/C10H16O2/c11-9-1-3-10(4-2-9)5-7-12-8-6-10/h1-8H2 |
| InChI Key | OOKHKTHERWWYQI-UHFFFAOYSA-N |
| MDL Number | MFCD17013084 |
| Molecular Formula | C10H16O2 |
| Molecular Weight | 168.2328 |
| SMILES | O=C1CCC2(CCOCC2)CC1 |
| Synonyms | 3-OXASPIRO[5.5]UNDECAN-9-ONE,
1159280-53-1,
3-?oxaspiro[5.5]?undecan-?9-?one,
SCHEMBL3733449,
DTXSID80738975,
OOKHKTHERWWYQI-UHFFFAOYSA-N,
KS-000008RR,
MFCD17013084,
ZINC72294351,
AKOS023413389,
MCULE-7173180110,
NE50390,
AS-38596,
CS-0051783,
Z1359881983,
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| Complexity | 168 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 168.115g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 12 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 168.236g/mol |
| Monoisotopic Mass | 168.115g/mol |
| Rotatable Bond Count | 0 |
| Topological Polar Surface Area | 26.3A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 0.9 |
GHS Hazard and Precautionary Statements
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Certificate of Analysis
Lot Number