| CAS Number | 1408075-68-2 |
| Catalog Number | AG001CTU(AGN-PC-0WCJAA) |
| Chemical Name | 8-oxa-2-aza-spiro[4.5]decane oxalate |
| IUPAC Name | 8-oxa-2-azaspiro[4.5]decane;oxalic acid |
| InChI | InChI=1S/C8H15NO.C2H2O4/c1-4-9-7-8(1)2-5-10-6-3-8;3-1(4)2(5)6/h9H,1-7H2;(H,3,4)(H,5,6) |
| InChI Key | BEEYWXWKBOFYSE-UHFFFAOYSA-N |
| MDL Number | MFCD23106140 |
| Molecular Formula | C10H17NO5 |
| Molecular Weight | 231.2457 |
| SMILES | OC(=O)C(O)=O.C1CC2(CN1)CCOCC2 |
| Synonyms | 8-oxa-2-azaspiro[4.5]decane oxalate,
1408075-68-2,
8-Oxa-2-aza-spiro[4.5]decane oxalate,
SCHEMBL20238088,
MFCD23106140,
AKOS025395693,
PB36135,
KS-000003Q2,
AK170703,
AS-51832,
CS-0049941,
Q-1742,
8-Oxa-2-azaspiro[4.5]decane, ethanedioate (1:1),
1408074-48-5,
|
| Complexity | 190 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 2 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 231.111g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 16 |
| Hydrogen Bond Acceptor Count | 6 |
| Hydrogen Bond Donor Count | 3 |
| Isotope Atom Count | 0 |
| Molecular Weight | 231.248g/mol |
| Monoisotopic Mass | 231.111g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 95.9A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
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Certificate of Analysis
Lot Number