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Linagliptin Impurity 5
[CAS# 2253964-85-9]

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Identification
NameLinagliptin Impurity 5
Synonyms7-but-2-ynyl-3-methyl-1-[(4-methylquinazolin-2-yl)methyl]-8-[[(3S)-piperidin-3-yl]amino]purine-2,6-dione
Molecular StructureCAS # 2253964-85-9, Linagliptin Impurity 5
Molecular FormulaC25H28N8O2
Molecular Weight472.54
CAS Registry Number2253964-85-9
SMILESCC#CCN1C2=C(N=C1N[C@H]3CCCNC3)N(C(=O)N(C2=O)CC4=NC5=CC=CC=C5C(=N4)C)C
Properties
Density1.4±0.1 g/cm3, Calc.*
Index of Refraction1.714, Calc.*
Boiling Point664.0±65.0 °C (760 mmHg), Calc.*
Flash Point355.4±34.3 °C, Calc.*
*Calculated using Advanced Chemistry Development (ACD/Labs) Software.
Safety Data
Hazard Symbolssymbol   GHS07 Warning  Details
Risk StatementsH302+H312+H332-H315-H319  Details
Safety StatementsP261-P271-P280-P302+P352-P305+P351+P338  Details
SDSAvailable
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