Product Code

TRC-S493503

CAS Number

1019640-33-5

Product Format

Neat

Molecular Formula

C21H33N3O • C7H8O3S

Molecular Weight

515.71

Product Categories

TRC, API Reference Standards & Research Materials

Product Type

API

Alternate CAS Number

57695-04-2

Price and availability

48-hour USA dispatch time

Freight restricted.

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Product Information

Chemical Data

Analyte Name

Sitamaquine Tosylate

CAS Number

1019640-33-5

Molecular Formula

C21H33N3O • C7H8O3S

Molecular Weight

515.71

Accurate Mass

515.46

SMILES

CCN(CC)CCCCCCNC1=CC(=CC2=C(C=CN=C12)C)OC.CC1=CC=C(C=C1)S(=O)(=O)O

InChI

InChI=1S/C21H33N3O.C7H8O3S/c1-5-24(6-2)14-10-8-7-9-12-22-20-16-18(25-4)15-19-17(3)11-13-23-21(19)20;1-6-2-4-7(5-3-6)11(8,9)10/h11,13,15-16,22H,5-10,12,14H2,1-4H3;2-5H,1H3,(H,8,9,10)

IUPAC

N1,N1-diethyl-N6-(6-methoxy-4-methylquinolin-8-yl)hexane-1,6-diamine 4-methylbenzenesulfonate

Alternate CAS Number

57695-04-2

Product Data

Shipping Temperature

Room Temperature

Country of Origin

CANADA

Product Format

Neat

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