Products 666816-91-7

CAS 666816-91-7 appears in our catalog under these names: Linagliptin Impurity 21, Linagliptin Impurity 15, 3-Methyl-7-(2-butyn-1-yl)-8-((R)-3-(tertbutyloxycarbonylamino)piperidin-1-yl)-xanthine. Offered by: Chemat Brand, Hubei YoungXin, TRC. Available pack sizes: on request, 10mg, 25mg, 50mg, 100mg, 200mg, 250mg.

Structural formula: {0} (CAS {1})

Tert-butyl N-[(3R)-1-(7-but-2-ynyl-3-methyl-2,6-dioxopurin-8-yl)piperidin-3-yl]carbamate (CAS 666816-91-7) is a chemical compound with the molecular formula C20H28N6O4 and a molecular weight of 416.5 g/mol. IUPAC name: tert-butyl N-[(3R)-1-(7-but-2-ynyl-3-methyl-2,6-dioxopurin-8-yl)piperidin-3-yl]carbamate. InChIKey: MKEXJLGKOKCUEB-CYBMUJFWSA-N.

Identity
Molecular formulaC20H28N6O4
Molecular weight416.5 g/mol
IUPAC nametert-butyl N-[(3R)-1-(7-but-2-ynyl-3-methyl-2,6-dioxopurin-8-yl)piperidin-3-yl]carbamate
InChIKeyMKEXJLGKOKCUEB-CYBMUJFWSA-N
SMILESCC#CCN1C2=C(N=C1N3CCC[C@H](C3)NC(=O)OC(C)(C)C)N(C(=O)NC2=O)C

Computed by PubChem (NCBI)