| CAS Number | 1357354-17-6 |
| Catalog Number | AG01BIYC |
| Chemical Name | tert-Butyl 8-(hydroxymethyl)-2,6-diazaspiro[3.4]octane-2-carboxylate |
| IUPAC Name | tert-butyl 5-(hydroxymethyl)-2,7-diazaspiro[3.4]octane-2-carboxylate |
| InChI | InChI=1S/C12H22N2O3/c1-11(2,3)17-10(16)14-7-12(8-14)6-13-4-9(12)5-15/h9,13,15H,4-8H2,1-3H3 |
| InChI Key | AKKICTYCRNCDKH-UHFFFAOYSA-N |
| MDL Number | MFCD22209567 |
| Molecular Formula | C12H22N2O3 |
| Molecular Weight | 242.3147 |
| SMILES | OCC1CNCC12CN(C2)C(=O)OC(C)(C)C |
| Synonyms | TERT-BUTYL 8-(HYDROXYMETHYL)-2,6-DIAZASPIRO[3.4]OCTANE-2-CARBOXYLATE,
1357354-17-6,
AM805618,
8-Hydroxymethyl-2,6-diaza-spiro[3.4]octane-2-carboxylic acid tert-butyl ester,
|
| Complexity | 305 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 242.163g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 17 |
| Hydrogen Bond Acceptor Count | 4 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 242.319g/mol |
| Monoisotopic Mass | 242.163g/mol |
| Rotatable Bond Count | 3 |
| Topological Polar Surface Area | 61.8A^2 |
| Undefined Atom Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | -0.1 |
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Certificate of Analysis
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