(R)-2,4-dihydroxy-N-[3-[(2-mercaptoethyl)amino]-3-oxopropyl]-3,3-dimethylbutyramide

Chemical Properties

alpha	D20 +12.9° (c = 4.5 in water)
Boiling point	635.0±55.0 °C(Predicted)
Density	1.202±0.06 g/cm3(Predicted)
storage temp.	-20°C
solubility	Methanol (Slightly), Water (Slightly)
form	Oil
pka	9.75±0.10(Predicted)
color	Pale Yellow to Light Yellow
optical activity	[α]/D 17±2°, c = 1 in H2O
BRN	1714196
InChI	InChI=1S/C11H22N2O4S/c1-11(2,7-14)9(16)10(17)13-4-3-8(15)12-5-6-18/h9,14,16,18H,3-7H2,1-2H3,(H,12,15)(H,13,17)/t9-/m0/s1
InChIKey	ZNXZGRMVNNHPCA-VIFPVBQESA-N
SMILES	C(NCCC(NCCS)=O)(=O)[C@H](O)C(C)(C)CO

Hazard Codes	T
Risk Statements	25
Safety Statements	45
RIDADR	UN 2811 6.1 / PGIII
WGK Germany	3
Storage Class	11 - Combustible Solids
Toxicity	LD50 intraperitoneal in mouse: 440mg/kg

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