| CAS Number | 1624261-43-3 |
| Catalog Number | AG001T4R(AGN-PC-0WCJVM) |
| Chemical Name | 1-Piperidinecarboxylic acid, 4,4-dibromo-, 1,1-dimethylethyl ester |
| IUPAC Name | tert-butyl 4,4-dibromopiperidine-1-carboxylate |
| InChI | InChI=1S/C10H17Br2NO2/c1-9(2,3)15-8(14)13-6-4-10(11,12)5-7-13/h4-7H2,1-3H3 |
| InChI Key | IBTAYOVUDZSXKE-UHFFFAOYSA-N |
| MDL Number | MFCD27978451 |
| Molecular Formula | C10H17Br2NO2 |
| Molecular Weight | 343.0555 |
| SMILES | BrC1(CCN(CC1)C(=O)OC(C)(C)C)Br |
| Synonyms | tert-Butyl 4,4-dibromopiperidine-1-carboxylate,
1624261-43-3,
MFCD27978451,
ZINC97463395,
AKOS024463144,
FCH2512476,
AK161636,
AS-46629,
OR302750,
AJ-138482,
CS-0037450,
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| Complexity | 238 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 342.961g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 15 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 343.059g/mol |
| Monoisotopic Mass | 340.963g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 29.5A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 3.1 |
GHS Hazard and Precautionary Statements
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Certificate of Analysis
Lot Number