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Macitentan impurity B
[CAS# 441796-13-0]

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Identification
NameMacitentan impurity B
SynonymsN-Despropyl-N-Ethyl Macitentan;5-(4-bromophenyl)-6-[2-(5-bromopyrimidin-2-yl)oxyethoxy]-N-(ethylsulfamoyl)pyrimidin-4-amine
Molecular StructureCAS # 441796-13-0, Macitentan impurity B
Molecular FormulaC18H18Br2N6O4S
Molecular Weight574.25
CAS Registry Number441796-13-0
SMILESCCNS(=O)(=O)NC1=C(C(=NC=N1)OCCOC2=NC=C(C=N2)Br)C3=CC=C(C=C3)Br
Properties
Density1.7±0.1 g/cm3, Calc.*
Index of Refraction1.642, Calc.*
Boiling Point686.7±65.0 °C (760 mmHg), Calc.*
Flash Point369.1±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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