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Elagolix Diester Impurity
[CAS# 2316733-81-8]

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Identification
NameElagolix Diester Impurity
Synonyms(R)-diethyl 4,4-((2-(5-(2-fluoro-3-methoxyphenyl)-3-(2-fluoro-6-(trifluoromethyl)benzyl)-4-methyl-2,6-dioxo-2,3-dihydropyrimidin-1(6H)-yl)-1-phenylethyl)azanediyl)dibutanoate
Molecular StructureCAS # 2316733-81-8, Elagolix Diester Impurity
Molecular FormulaC40H44F5N3O7
Molecular Weight773.79
CAS Registry Number2316733-81-8
SMILESCCOC(=O)CCCN(CCCC(=O)OCC)[C@@H](CN1C(=O)C(=C(N(C1=O)CC2=C(C=CC=C2F)C(F)(F)F)C)C3=C(C(=CC=C3)OC)F)C4=CC=CC=C4
Properties
Density1.3±0.1 g/cm3, Calc.*
Index of Refraction1.542, Calc.*
Boiling Point765.3±70.0 °C (760 mmHg), Calc.*
Flash Point416.7±35.7 °C, Calc.*
*Calculated using Advanced Chemistry Development (ACD/Labs) Software.
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