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Bis(2-chloroethyl)-amine-[13C4] hydrochloride

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General Information
Catalog: BLP-000076
Molecular Formula: [13C]4H10Cl3N
Molecular Weight: 182.46

Chemical Structure

Description	Bis(2-chloroethyl)-amine-[13C4] hydrochloride, is the labelled analogue of Bis(2-chloroethyl)-amine hydrochloride. Bis(2-chloroethyl)amine Hydrochloride is a cytotoxic metabolite of Cyclophosphamide
Synonyms	Bis(2-chloroethyl)-13C4-amine hydrochloride
IUPAC Name	2-chloro-N-(2-chloro(1,2-13C2)ethyl)(1,2-13C2)ethanamine;hydrochloride
Related CAS	821-48-7 (unlabelled)
Canonical SMILES	C(CCl)NCCCl.Cl
InChI	InChI=1S/C4H9Cl2N.ClH/c5-1-3-7-4-2-6;/h7H,1-4H2;1H/i1+1,2+1,3+1,4+1;
InChI Key	YMDZDFSUDFLGMX-UJNKEPEOSA-N
Melting Point	212-214 °C (lit.)
Purity	99% atom 13C