95923-44-7 Purity
96%
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Specification
The molecular formula is C18H24BrNO4.
Some synonyms include 1-Boc-3-(4-bromobenzyl)-3-carboxypiperidine, 959235-99-5, and 1-n-boc-3-(4-bromobenzyl)piperidine-3-carboxylic acid.
The molecular weight is 398.3 g/mol.
The IUPAC Name is 3-[(4-bromophenyl)methyl]-1-[(2-methylpropan-2-yl)oxycarbonyl]piperidine-3-carboxylic acid.
The InChI key is UZAOGJFKELZIGV-UHFFFAOYSA-N.
The compound has 1 hydrogen bond donor count.
The topological polar surface area is 66.8 2.
No, it does not have a defined atom stereocenter count.
The compound has 5 rotatable bond counts.
Yes, the compound is canonicalized.