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2-(Morpholine-4-Carbothioylsulfanyl)Acetic Acid
[CAS# 6317-17-5]

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Identification
Name 2-(Morpholine-4-Carbothioylsulfanyl)Acetic Acid
Synonyms 2-[(Morpholino-Thioxomethyl)Thio]Acetic Acid; 2-(Morpholine-4-Carbothioylthio)Acetic Acid; 2-Morpholin-4-Ylcarbothioylsulfanylethanoic Acid
Molecular Structure CAS#: 6317-17-5, 2-(Morpholine-4-Carbothioylsulfanyl)Acetic Acid
Molecular Formula C7H11NO3S2
Molecular Weight 221.29
CAS Registry Number 6317-17-5
SMILES C(C(=O)O)SC(N1CCOCC1)=S
InChI 1S/C7H11NO3S2/c9-6(10)5-13-7(12)8-1-3-11-4-2-8/h1-5H2,(H,9,10)
InChIKey JCECLSATASZQQB-UHFFFAOYSA-N
Properties
Density 1.448g/cm3 (Cal.)
Boiling point 389.787°C at 760 mmHg (Cal.)
Flash point 189.537°C (Cal.)
References
(1) Kong Mun Lo and Seik Weng Ng . 2-(4-Morpholinecarbothioylsulfanyl)acetic acid , Acta Cryst (2010). E66, o1078  
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