Montelukast gem-dimethylmethylene analogue

CAS

162489-70-5

Catalog Number

ACM162489705

Category

Other Products

Molecular Weight

588.20

Molecular Formula

C₃₅H₃₈ClNO₃S

MSDS COA Spec Sheet

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Specification

Synonyms

[R-(E)]-

IUPAC Name

4-[(1R)-1-[3-[2-(7-chloroquinolin-2-yl)ethenyl]phenyl]-3-[2-(2-hydroxypropan-2-yl)phenyl]propyl]sulfanyl-3,3-dimethylbutanoic acid

Canonical SMILES

CC(C)(CC(=O)O)CSC(CCC1=CC=CC=C1C(C)(C)O)C2=CC=CC(=C2)C=CC3=NC4=C(C=CC(=C4)Cl)C=C3

InChI Key

AQCSHUUQIJHHLI-JGCGQSQUSA-N

Boiling Point

742.405ºC at 760 mmHg

Flash Point

402.792ºC

Density

1.23g/cm³

Exact Mass

587.22600

H-Bond Acceptor

H-Bond Donor

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