Montelukast sodium

CAS

151767-02-1

Catalog Number

ACM151767021

Category

Other Products

Molecular Weight

608.17

Molecular Formula

C₃₅H₃₅ClNNaO₃S

MSDS COA Spec Sheet

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Specification

Synonyms

singulair;MONTELUKAST NA;MONTELUKAST SODIUM;mk-476;2-[1-[[1-[3-[2-[(7-chloro-2-quinolyl)]vinyl]phenyl]-3-[2-(1-hydroxy-1-methyl-ethyl)phenyl]-propyl]sulfanylmethyl]cyclopropyl]acetic acid sodium salt;1-[1-[[[(1R)-1-[3-[(1E)-2-(7-Chloro-2-quinolinyl)ethenyl]phenyl]-3-[2-(1-hydroxy-1-methylethyl)phenyl]propyl]thio]methyl]cyclopropaneacetic;MK-476, Singulair;Montelukast, Sodium Salt

Hazard Statements

Safety Description

Supplemental Hazard Statements

H318-H361fd

Symbol

GHS05,GHS08

What is the molecular formula of Montelukast sodium?

The molecular formula of Montelukast sodium is C35H35ClNNaO3S.

What is the molecular weight of Montelukast sodium?

The molecular weight of Montelukast sodium is 608.2 g/mol.

What is the IUPAC name of Montelukast sodium?

The IUPAC name of Montelukast sodium is sodium;2-[1-[[(1R)-1-[3-[(E)-2-(7-chloroquinolin-2-yl)ethenyl]phenyl]-3-[2-(2-hydroxypropan-2-yl)phenyl]propyl]sulfanylmethyl]cyclopropyl]acetate.

What is the InChI key of Montelukast sodium?

The InChI key of Montelukast sodium is LBFBRXGCXUHRJY-HKHDRNBDSA-M.

What is the canonical SMILES of Montelukast sodium?

The canonical SMILES of Montelukast sodium is CC(C)(C1=CC=CC=C1CCC(C2=CC=CC(=C2)C=CC3=NC4=C(C=CC(=C4)Cl)C=C3)SCC5(CC5)CC(=O)[O-])O.[Na+].

What is the CAS number of Montelukast sodium?

The CAS number of Montelukast sodium is 151767-02-1.

What is the ChEMBL ID of Montelukast sodium?

The ChEMBL ID of Montelukast sodium is CHEMBL1200681.

How many hydrogen bond donor counts does Montelukast sodium have?

Montelukast sodium has 1 hydrogen bond donor count.

How many hydrogen bond acceptor counts does Montelukast sodium have?

Montelukast sodium has 5 hydrogen bond acceptor counts.