Melphalan-d8 Monohydrochloride

Analyte Name

Melphalan-d8 Hydrochloride

CAS Number

1217854-43-7

Molecular Formula

C13H10D8Cl2N2O2 . HCl

Molecular Weight

349.71

Accurate Mass

348.1

SMILES

[2H]C(C([2H])(Cl)[2H])(N(C([2H])(C([2H])(Cl)[2H])[2H])C1=CC=C(C[C@H](N)C(O)=O)C=C1)[2H].Cl

InChI

InChI=1S/C13H18Cl2N2O2.ClH/c14-5-7-17(8-6-15)11-3-1-10(2-4-11)9-12(16)13(18)19;/h1-4,12H,5-9,16H2,(H,18,19);1H/t12-;/m0./s1/i5D2,6D2,7D2,8D2;

IUPAC

(S)-2-amino-3-(4-(bis(2-chloroethyl-1,1,2,2-d4)amino)phenyl)propanoic acid hydrochloride

Alternate CAS Number

Monohydrochloride salt: 1217854-43-7

Unlabelled CAS Number

Monohydrochloride salt: 3223-07-2

SIL Type

Deuterium

Storage Temperature

-20°C

Shipping Temperature

Room Temperature

Country of Origin

CANADA

Product Format

Neat

API Family

Melphalan