| CAS Number | 1697729-82-0 |
| Catalog Number | AG01B1CJ |
| Chemical Name | 4-{[(tert-butoxy)carbonyl]amino}-3-methoxybutanoic acid |
| IUPAC Name | 3-methoxy-4-[(2-methylpropan-2-yl)oxycarbonylamino]butanoic acid |
| InChI | InChI=1S/C10H19NO5/c1-10(2,3)16-9(14)11-6-7(15-4)5-8(12)13/h7H,5-6H2,1-4H3,(H,11,14)(H,12,13) |
| InChI Key | PQBDONMJJFRKOE-UHFFFAOYSA-N |
| MDL Number | MFCD28023728 |
| Molecular Formula | C10H19NO5 |
| Molecular Weight | 233.2616 |
| SMILES | COC(CC(O)=O)CNC(OC(C)(C)C)=O |
| Synonyms | 4-{[(tert-butoxy)carbonyl]amino}-3-methoxybutanoic acid,
1697729-82-0,
AKOS033643696,
Z1881620430,
|
| Complexity | 246 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 233.126g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 16 |
| Hydrogen Bond Acceptor Count | 5 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 233.264g/mol |
| Monoisotopic Mass | 233.126g/mol |
| Rotatable Bond Count | 7 |
| Topological Polar Surface Area | 84.9A^2 |
| Undefined Atom Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 0.3 |
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Certificate of Analysis
Lot Number