Products 1398113-31-9

CAS 1398113-31-9 is the registry number for 1-(tert-Butyl) 2-methyl (2S)-4-hydroxy-4-(trifluoromethyl)pyrrolidine-1,2-dicarboxylate, 98%. Offered by: Chemat Brand. Available pack sizes: on request.

1-(tert-Butyl) 2-methyl (2S)-4-hydroxy-4-(trifluoromethyl)pyrrolidine-1,2-dicarboxylate, 98%
Chemat Brand
  • size: on request
  • Variants: 1
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Structural formula: {0} (CAS {1})

1-O-tert-butyl 2-O-methyl (2S)-4-hydroxy-4-(trifluoromethyl)pyrrolidine-1,2-dicarboxylate (CAS 1398113-31-9) is a chemical compound with the molecular formula C12H18F3NO5 and a molecular weight of 313.27 g/mol. IUPAC name: 1-O-tert-butyl 2-O-methyl (2S)-4-hydroxy-4-(trifluoromethyl)pyrrolidine-1,2-dicarboxylate. InChIKey: DGNCWUHYOGSFKN-RGENBBCFSA-N.

Identity
Molecular formulaC12H18F3NO5
Molecular weight313.27 g/mol
IUPAC name1-O-tert-butyl 2-O-methyl (2S)-4-hydroxy-4-(trifluoromethyl)pyrrolidine-1,2-dicarboxylate
InChIKeyDGNCWUHYOGSFKN-RGENBBCFSA-N
SMILESCC(C)(C)OC(=O)N1CC(C[C@H]1C(=O)OC)(C(F)(F)F)O

Computed by PubChem (NCBI)

Synonyms: DGNCWUHYOGSFKN-RGENBBCFSA-N
Related forms of this compound
1-O-tert-butyl 2-O-methyl (2S,4S)-4-hydroxy-4-(trifluoromethyl)pyrrolidine-1,2-dicarboxylate C12H18F3NO5
Isomers (same molecular formula)
(2R,4R)-4-hydroxy-1-[(2-methylpropan-2-yl)oxycarbonyl]-4-(trifluoromethyl)piperidine-2-carboxylic acid C12H18F3NO5
(2R,4S)-4-hydroxy-1-[(2-methylpropan-2-yl)oxycarbonyl]-4-(trifluoromethyl)piperidine-2-carboxylic acid C12H18F3NO5
(2S,4S)-4-methoxy-1-[(2-methylpropan-2-yl)oxycarbonyl]-4-(trifluoromethyl)pyrrolidine-2-carboxylic acid C12H18F3NO5
1-O-tert-butyl 2-O-methyl (2S,4R)-4-(trifluoromethoxy)pyrrolidine-1,2-dicarboxylate C12H18F3NO5