| CAS Number | 1446012-48-1 |
| Catalog Number | AG00HX6D(AGN-PC-0WCKMW) |
| Chemical Name | 6-(Hydroxymethyl)-2-Boc-5-oxa-2-azaspiro[3.4]octane |
| IUPAC Name | tert-butyl 6-(hydroxymethyl)-5-oxa-2-azaspiro[3.4]octane-2-carboxylate |
| InChI | InChI=1S/C12H21NO4/c1-11(2,3)17-10(15)13-7-12(8-13)5-4-9(6-14)16-12/h9,14H,4-8H2,1-3H3 |
| InChI Key | IQPBJPYNUXVTEC-UHFFFAOYSA-N |
| MDL Number | MFCD27986992 |
| Molecular Formula | C12H21NO4 |
| Molecular Weight | 243.2994 |
| SMILES | OCC1CCC2(O1)CN(C2)C(=O)OC(C)(C)C |
| Synonyms | 1446012-48-1,
6-(Hydroxymethyl)-2-Boc-5-oxa-2-azaspiro[3.4]octane,
tert-Butyl 6-(hydroxymethyl)-5-oxa-2-azaspiro[3.4]octane-2-carboxylate,
MFCD27986992,
AKOS025403685,
SB11660,
CS-0037633,
t-Butyl 6-(hydroxymethyl)-5-oxa-2-azaspiro[3.4]octane-2-carboxylate,
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| Complexity | 304 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 243.147g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 17 |
| Hydrogen Bond Acceptor Count | 4 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 243.303g/mol |
| Monoisotopic Mass | 243.147g/mol |
| Rotatable Bond Count | 3 |
| Topological Polar Surface Area | 59A^2 |
| Undefined Atom Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 0.5 |
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Certificate of Analysis
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