Melphalan-d8 Dihydrochloride
Product Code
TRC-M216902
CAS Number
2 AnalytesProduct Format
Neat
Product Categories
Modified amino acids, Amino acids, TRC, Stable isotopes, Stable Isotope Labelled Analytical Standards, Cancer Research Chemicals and Analytical Standards
Product Type
Stable Isotope LabelledAlternate CAS Number
2 AnalytesUnlabelled CAS Number
2 AnalytesDocumentation
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Product Information
Chemical Data
Analyte Name
Concentration
CAS Number
Molecular Structure
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Alternate CAS Number
Unlabelled CAS Number
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InChI
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IUPAC
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Melphalan-d8 Dihydrochloride
CAS Number
-
Alternate CAS Number
Unlabelled CAS Number
Molecular Formula
C13H12D8Cl4N2O2
Molecular Weight
386.17
Accurate Mass
384.08
SMILES
OC([C@H](CC1=CC=C(C=C1)N(C([2H])(C([2H])(Cl)[2H])[2H])C([2H])(C([2H])(Cl)[2H])[2H])N)=O.Cl.Cl
InChI
InChI=1S/C13H18Cl2N2O2.2ClH/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);2*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 dihydrochloride
Melphalan-d8 Hydrochloride
CAS Number
Alternate CAS Number
Unlabelled CAS Number
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
Product Data
Storage Temperature
-20°C
Shipping Temperature
Room Temperature
Country of Origin
CANADA
Product Type
Stable Isotope Labelled
Product Format
Neat
Product Description
Antineoplastic.
References: Ross, W.C.J., et al.: Biochem. Pharmacol., 13, 969 (1964); Donelli, M.G., et al.: J. Pharm. Pharmacol., 18, 760 (1966), Furner, R.L., et al.: Cancer Treat. Rep., 64, 559 (1980),
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