2-(Benzothioylthio)acetic acid

About This Item

Molecular Formula	C₉H₈O₂S₂
CAS Number	942-91-6

FC-0136638

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Properties

Chemical Identifiers

IUPAC Name	2-(benzenecarbonothioylsulfanyl)acetic acid
SMILES	C1=CC=C(C=C1)C(=S)SCC(=O)O
InChI Key	XBEIANFIOZTEDE-UHFFFAOYSA-N
InChI	InChI=1S/C9H8O2S2/c10-8(11)6-13-9(12)7-4-2-1-3-5-7/h1-5H,6H2,(H,10,11)

Physical Properties

Boiling Point	375.5±44.0 °C at 760 mmHg
Melting Point	125-127 °C(lit.)
Flash Point	180.9±28.4 °C
Density	1.4±0.1 g/cm3

Safety Information

Hazard Class

Warning

Flash Point

180.9±28.4 °C

Please refer to the Safety Data Sheet (SDS) for complete handling, storage, and disposal instructions. Follow all applicable regulations when working with this chemical reagent.