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O,O-Diethyl Thiophosphate-[13C4] Ammonium Salt

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General Information
Catalog: BLP-003611
CAS: 1330162-89-4
Molecular Formula: [13C]4H14NO3PS
Molecular Weight: 191.17

Chemical Structure

Description	O,O-Diethyl Thiophosphate-[13C4] Ammonium Salt, is the labelled analogue of O,O-Diethyl Thiophosphate. It is used in the synthesis of novel phosphorothioates and phosphorodithioates as cholinesterase inhibitors.
Synonyms	O,O-Diethyl Thiophosphate-13C4 Ammonium Salt
IUPAC Name	azane;di((1,2-13C2)ethoxy)-hydroxy-sulfanylidene-λ5-phosphane
Related CAS	5871-16-9 (unlabelled)
Canonical SMILES	CCOP(=S)(O)OCC.N
InChI	InChI=1S/C4H11O3PS.H3N/c1-3-6-8(5,9)7-4-2;/h3-4H2,1-2H3,(H,5,9);1H3/i1+1,2+1,3+1,4+1;
InChI Key	IBGKZCJDWXXWNU-UJNKEPEOSA-N
Melting Point	137-142°C
Purity	95% by CP; 98% atom 13C
Solubility	Soluble in DMSO, Methanol
Appearance	White to Off-white Solid
Storage	Store at-20°C, Under inert atmosphere