| CAS Number | 1581752-93-3 |
| Catalog Number | AG00ABFJ(AGN-PC-0WOAY2) |
| Chemical Name | (2R,6R)-4-(tert-butoxycarbonyl)-6-methylmorpholine-2-carboxylic acid |
| IUPAC Name | (2R,6R)-6-methyl-4-[(2-methylpropan-2-yl)oxycarbonyl]morpholine-2-carboxylic acid |
| InChI | InChI=1S/C11H19NO5/c1-7-5-12(6-8(16-7)9(13)14)10(15)17-11(2,3)4/h7-8H,5-6H2,1-4H3,(H,13,14)/t7-,8-/m1/s1 |
| InChI Key | IJMIYSXHHOKJEZ-HTQZYQBOSA-N |
| MDL Number | MFCD18642708 |
| Molecular Formula | C11H19NO5 |
| Molecular Weight | 245.2723 |
| SMILES | C[C@H]1O[C@H](CN(C1)C(=O)OC(C)(C)C)C(=O)O |
| Synonyms | (2R,6R)-4-(tert-butoxycarbonyl)-6-methylmorpholine-2-carboxylic acid,
1581752-93-3,
SCHEMBL17013355,
CS-D1486,
CS-M0532,
AKOS034814024,
ZINC214469714,
CS-13508,
Z2568757965,
(2R,6R)-4-[(tert-butoxy)carbonyl]-6-methylmorpholine-2-carboxylic acid,
2,4-Morpholinedicarboxylic acid,6-methyl-,4-(1,1-dimethylethyl) ester, (2R,6R)-,
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| Complexity | 310 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 2 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 245.126g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 17 |
| Hydrogen Bond Acceptor Count | 5 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 245.275g/mol |
| Monoisotopic Mass | 245.126g/mol |
| Rotatable Bond Count | 3 |
| Topological Polar Surface Area | 76.1A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 0.8 |
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Certificate of Analysis
Lot Number