| CAS Number | 1523571-05-2 |
| Catalog Number | AG003A63(AGN-PC-0WD6U9) |
| Chemical Name | 6-oxa-2-azaspiro[3.4]octane hemioxalate |
| IUPAC Name | 6-oxa-2-azaspiro[3.4]octane;oxalic acid |
| InChI | InChI=1S/2C6H11NO.C2H2O4/c2*1-2-8-5-6(1)3-7-4-6;3-1(4)2(5)6/h2*7H,1-5H2;(H,3,4)(H,5,6) |
| InChI Key | DXQBWHZOWKIQGE-UHFFFAOYSA-N |
| MDL Number | MFCD27988098 |
| Molecular Formula | C14H24N2O6 |
| Molecular Weight | 316.3502 |
| SMILES | O=C(O)C(O)=O.C1NCC12COCC2.C3NCC34COCC4 |
| Synonyms | 6-oxa-2-azaspiro[3.4]octane hemioxalate,
1523571-05-2,
6-Oxa-2-azaspiro[3.4]octane oxalate(2:1),
6-Oxa-2-azaspiro[3.4]octane oxalate (2:1),
MFCD27988098,
AKOS025147114,
SB21682,
KS-000008F6,
AK164852,
AS-34931,
AX8298435,
CS-0050154,
EN300-226529,
1392804-58-8,
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| Complexity | 170 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 3 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 316.163g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 22 |
| Hydrogen Bond Acceptor Count | 8 |
| Hydrogen Bond Donor Count | 4 |
| Isotope Atom Count | 0 |
| Molecular Weight | 316.354g/mol |
| Monoisotopic Mass | 316.163g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 117A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
GHS Hazard and Precautionary Statements
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Certificate of Analysis
Lot Number