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Carboxyphosphamide-[d4]

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General Information
Catalog: BLP-002162
CAS: 1246817-74-2
Molecular Formula: C7H11D4Cl2N2O4P
Molecular Weight: 297.11

Chemical Structure

Description	Carboxyphosphamide-[d4], is the labelled analogue of Carboxyphosphamide, which is a metabolite of Cyclophosphamide. Cyclophosphamide is a medication used as chemotherapy and to suppress the immune system.
Synonyms	Carboxyphosphamide D4
IUPAC Name	3-[amino-[bis(2-chloro-2,2-dideuterioethyl)amino]phosphoryl]oxypropanoic acid
Related CAS	22788-18-7 (unlabelled)
Canonical SMILES	C(COP(=O)(N)N(CCCl)CCCl)C(=O)O
InChI	InChI=1S/C7H15Cl2N2O4P/c8-2-4-11(5-3-9)16(10,14)15-6-1-7(12)13/h1-6H2,(H2,10,14)(H,12,13)/i2D2,3D2
InChI Key	QLAKAJLYYGOZQL-RRVWJQJTSA-N
Melting Point	107-112°C
Purity	97% (CP); 98% atom D
Solubility	Soluble in Chloroform, Methanol
Appearance	Off-white to Pale Yellow Solid
Storage	Store at -20°C, under inert atmosphere