| CAS Number | 2205334-86-5 |
| Catalog Number | AG01DTWW(AGN-PC-3H45D0) |
| Chemical Name | oxalic acid; tert-butyl 3-amino-1-oxa-8-azaspiro[4.5]decane-8-carboxylate |
| IUPAC Name | tert-butyl 3-amino-1-oxa-8-azaspiro[4.5]decane-8-carboxylate;oxalic acid |
| InChI | InChI=1S/C13H24N2O3.C2H2O4/c1-12(2,3)18-11(16)15-6-4-13(5-7-15)8-10(14)9-17-13;3-1(4)2(5)6/h10H,4-9,14H2,1-3H3;(H,3,4)(H,5,6) |
| InChI Key | UJXSWBRYTLRKGV-UHFFFAOYSA-N |
| MDL Number | MFCD28992035 |
| Molecular Formula | C15H26N2O7 |
| Molecular Weight | 346.3761 |
| SMILES | OC(=O)C(O)=O.CC(C)(C)OC(=O)N1CCC2(CC(N)CO2)CC1 |
| Synonyms | Tert-Butyl3-Amino-1-Oxa-8-Azaspiro[4.5]Decane-8-Carboxylate Oxalate,
2205334-86-5,
CS-0040002,
tert-Butyl 3-amino-1-oxa-8-azaspiro[4.5]decane-8-carboxylate oxalate,
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| Complexity | 388 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 2 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 346.174g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 24 |
| Hydrogen Bond Acceptor Count | 8 |
| Hydrogen Bond Donor Count | 3 |
| Isotope Atom Count | 0 |
| Molecular Weight | 346.38g/mol |
| Monoisotopic Mass | 346.174g/mol |
| Rotatable Bond Count | 3 |
| Topological Polar Surface Area | 139A^2 |
| Undefined Atom Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
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Certificate of Analysis
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