Product Code

TRC-C379969

CAS Number

1854126-42-3

Product Format

Neat

Molecular Formula

C18H21D5ClN3 • 2(H3O4P)

Molecular Weight

520.89

Product Categories

TRC, Stable isotopes, Pharmaceutical Toxicology Reference Materials

Product Type

Stable Isotope Labelled, Bioactive Small Molecule

Unlabelled CAS Number

50-63-5

Price and availability

48-hour USA dispatch time

Freight restricted.

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Product Information

Chemical Data

Analyte Name

Chloroquine-D5 Phosphate Salt

CAS Number

1854126-42-3

Molecular Formula

C18H21D5ClN3 • 2(H3O4P)

Molecular Weight

520.89

Accurate Mass

520.17

SMILES

O=P(O)(O)O.ClC1=CC=C2C(N=CC=C2NC(CCCN(C([2H])([2H])C([2H])([2H])[2H])CC)C)=C1.O=P(O)(O)O

InChI

InChI=1S/C18H26ClN3.2H3O4P/c1-4-22(5-2)12-6-7-14(3)21-17-10-11-20-18-13-15(19)8-9-16(17)18;2*1-5(2,3)4/h8-11,13-14H,4-7,12H2,1-3H3,(H,20,21);2*(H3,1,2,3,4)/i1D3,4D2;;

IUPAC

N4-(7-chloroquinolin-4-yl)-N1-ethyl-N1-(ethyl-d5)pentane-1,4-diamine bis(phosphate)

Unlabelled CAS Number

50-63-5

SIL Type

Deuterium

Product Data

Shipping Temperature

Room Temperature

Country of Origin

CANADA

Product Format

Neat

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Chloroquine-D5 Phosphate Salt

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