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Montelukast Acid Methyl Ester
[CAS# 855473-51-7]

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Identification
NameMontelukast Acid Methyl Ester
Synonymsmethyl 2-[1-[[(1R)-1-[3-[(E)-2-(7-chloroquinolin-2-yl)ethenyl]phenyl]-3-[2-(2-hydroxypropan-2-yl)phenyl]propyl]sulfanylmethyl]cyclopropyl]acetate
Molecular StructureCAS # 855473-51-7, Montelukast Acid Methyl Ester
Molecular FormulaC36H38ClNO3S
Molecular Weight600.21
CAS Registry Number855473-51-7
SMILESCC(C)(C1=CC=CC=C1CC[C@H](C2=CC=CC(=C2)/C=C/C3=NC4=C(C=CC(=C4)Cl)C=C3)SCC5(CC5)CC(=O)OC)O
Properties
Density1.2±0.1 g/cm3, Calc.*
Index of Refraction1.656, Calc.*
Boiling Point711.2±60.0 °C (760 mmHg), Calc.*
Flash Point383.9±32.9 °C, Calc.*
*Calculated using Advanced Chemistry Development (ACD/Labs) Software.
Safety Data
Hazard Symbolssymbol   GHS07 Warning  Details
Risk StatementsH315-H319-H335  Details
Safety StatementsP261-P264-P271-P280-P302+P352-P304+P340-P305+P351+P338-P312-P321-P332+P313-P337+P313-P362-P403+P233-P405-P501  Details
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