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N-Acetyl-S-ethyl-L-cysteine-[d5]

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General Information
Catalog: BLP-004898
CAS: 1279033-91-8
Molecular Formula: C7H8D5NO3S
Molecular Weight: 196.28

Chemical Structure

Synonyms	N-Acetyl-S-ethyl-L-cysteine D5; N-Acetyl-3-(ethylthio)alanine-d5; N-Acetyl-3-(ethylthio)-L-alanine-d5; Ethylmercapturic Acid-d5; N-Acetyl-S-ethylcysteine-d5; N-Acetyl-S-ethyl-d5-L-cysteine
IUPAC Name	(2R)-2-acetamido-3-(1,1,2,2,2-pentadeuterioethylsulfanyl)propanoic acid
Related CAS	31386-36-4 (unlabelled)
Canonical SMILES	CCSCC(C(=O)O)NC(=O)C
InChI	InChI=1S/C7H13NO3S/c1-3-12-4-6(7(10)11)8-5(2)9/h6H,3-4H2,1-2H3,(H,8,9)(H,10,11)/t6-/m0/s1/i1D3,3D2
InChI Key	BSVHABSINROVJJ-UUCRSUAGSA-N
Melting Point	50-60°C
Purity	≥99%; ≥99% atom D
Solubility	Soluble in Methanol; Slightly soluble in Water
Appearance	White to Off-white Solid
Storage	Store at -20°C under inert atmosphere