103301-73-1 Purity
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Specification
The molecular formula is C25H28N2O6.
The molecular weight is 452.5 g/mol.
Some synonyms include 1034574-30-5, (S)-1-N-Boc-4-N-Fmoc-piperazine-2-carboxylic acid, and (S)-1-N-Boc-4-N-Fmoc-piperazine2-carboxylic acid.
The IUPAC name is (2S)-4-(9H-fluoren-9-ylmethoxycarbonyl)-1-[(2-methylpropan-2-yl)oxycarbonyl]piperazine-2-carboxylic acid.
The InChI is InChI=1S/C25H28N2O6/c1-25(2,3)33-24(31)27-13-12-26(14-21(27)22(28)29)23(30)32-15-20-18-10-6-4-8-16(18)17-9-5-7-11-19(17)20/h4-11,20-21H,12-15H2,1-3H3,(H,28,29)/t21-/m0/s1.
The InChIKey is ZVHNNCSUTNWKFC-NRFANRHFSA-N.
The compound has 1 hydrogen bond donor count.
The compound has 6 hydrogen bond acceptor counts.
The XLogP3-AA value is 3.5.
Yes, the compound is canonicalized.