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
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
Molecular Formula
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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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