| CAS Number | 1445950-79-7 |
| Catalog Number | AG00HX3P(AGN-PC-0WG4GX) |
| Chemical Name | tert-butyl 9-(hydroxymethyl)-8-oxo-2,7-diazaspiro[4.4]nonane-2-carboxylate |
| IUPAC Name | tert-butyl 9-(hydroxymethyl)-8-oxo-2,7-diazaspiro[4.4]nonane-2-carboxylate |
| InChI | InChI=1S/C13H22N2O4/c1-12(2,3)19-11(18)15-5-4-13(8-15)7-14-10(17)9(13)6-16/h9,16H,4-8H2,1-3H3,(H,14,17) |
| InChI Key | HCZBXZAICRTFQV-UHFFFAOYSA-N |
| MDL Number | MFCD25509370 |
| Molecular Formula | C13H22N2O4 |
| Molecular Weight | 270.3248 |
| SMILES | CC(C)(C)OC(=O)N1CCC2(CNC(=O)C2CO)C1 |
| Synonyms | tert-Butyl 9-(hydroxymethyl)-8-oxo-2,7-diazaspiro[4.4]nonane-2-carboxylate,
1445950-79-7,
MFCD25509370,
CS-0036802,
t-Butyl 9-(hydroxymethyl)-8-oxo-2,7-diazaspiro[4.4]nonane-2-carboxylate,
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| Complexity | 391 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 270.158g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 19 |
| Hydrogen Bond Acceptor Count | 4 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 270.329g/mol |
| Monoisotopic Mass | 270.158g/mol |
| Rotatable Bond Count | 3 |
| Topological Polar Surface Area | 78.9A^2 |
| Undefined Atom Stereocenter Count | 2 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 0.3 |
GHS Hazard and Precautionary Statements
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Certificate of Analysis
Lot Number