(R,R)-Montelukast Bis-sulfide (~90%)
Product Code
TRC-M567970
CAS Number
Product Format
Neat
Molecular Formula
C41 H46 Cl N O5 S2
Molecular Weight
732.39
API Family
MontelukastProduct Categories
TRC, Impurity Reference Materials , Additional Covid-19 Research materials
Product Type
ImpurityAlternate CAS Number
Price and availability
Documentation
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Product Information
Product Data
Analyte Name
(R,R)-Montelukast Bis-sulfide
CAS Number
1187586-61-3
Molecular Formula
C41 H46 Cl N O5 S2
Molecular Weight
732.39
Accurate Mass
731.2506
SMILES
CC(C)(O)c1ccccc1CC[C@@H](SCC2(CC(=O)O)CC2)c3cccc(c3)[C@@H](Cc4ccc5ccc(Cl)cc5n4)SCC6(CC(=O)O)CC6
InChI
InChI=1S/C41H46ClNO5S2/c1-39(2,48)33-9-4-3-6-27(33)12-15-35(49-25-40(16-17-40)23-37(44)45)29-7-5-8-30(20-29)36(50-26-41(18-19-41)24-38(46)47)22-32-14-11-28-10-13-31(42)21-34(28)43-32/h3-11,13-14,20-21,35-36,48H,12,15-19,22-26H2,1-2H3,(H,44,45)(H,46,47)/t35-,36-/m1/s1
IUPAC
2-[1-[[(1R)-1-[3-[(1R)-1-[[1-(carboxymethyl)cyclopropyl]methylsulfanyl]-2-(7-chloro-2-quinolyl)ethyl]phenyl]-3-[2-(1-hydroxy-1-methyl-ethyl)phenyl]propyl]sulfanylmethyl]cyclopropyl]acetic acid
Alternate CAS Number
Mix of diastereomers: 1242260-05-4
Storage & Transport Information
Storage Temperature
+4°C
Shipping Temperature
Room Temperature
Country of Origin
CANADA
Product Attributes
Product Type
Impurity
Product Format
Neat
API Family
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