(R) - Methyl 3- Bromo- 2- ((tert- butoxycarbonyl) amino) propanoate - CAS 175844-11-8
Catalog: |
BB059800 |
Product Name: |
(R) - Methyl 3- Bromo- 2- ((tert- butoxycarbonyl) amino) propanoate |
CAS: |
175844-11-8 |
Synonyms: |
3-Bbromo- N- [(1, 1- dimethylethoxy) carbonyl] - L- alanine, Methyl Ester |
IUPAC Name: | methyl (2R)-3-bromo-2-[(2-methylpropan-2-yl)oxycarbonylamino]propanoate |
Description: | (R) - Methyl 3- Bromo- 2- ((tert- butoxycarbonyl) amino) propanoate is a chiral reagent used in organic synthesis. Used in the synthesis of selenocysteine-containing peptides. |
Molecular Weight: | 282.13 |
Molecular Formula: | C9H16BrNO4 |
Canonical SMILES: | CC(C)(C)OC(=O)NC(CBr)C(=O)OC |
InChI: | InChI=1S/C9H16BrNO4/c1-9(2,3)15-8(13)11-6(5-10)7(12)14-4/h6H,5H2,1-4H3,(H,11,13)/t6-/m0/s1 |
InChI Key: | ODLDPRMMKCMNMD-LURJTMIESA-N |
References: | Gieselman, M. et al. Org. Lett., 3, 1331 (2001). |
Complexity: | 237 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 1 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 281.02627 |
Formal Charge: | 0 |
Heavy Atom Count: | 15 |
Hydrogen Bond Acceptor Count: | 4 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 281.02627 |
Rotatable Bond Count: | 6 |
Topological Polar Surface Area: | 64.6Ų |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 1.6 |
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