ChemicalBook--->CAS DataBase List--->5823-51-8

5823-51-8

5823-51-8 Structure

5823-51-8 Structure
IdentificationBack Directory
[Name]

[1,2,5]THIADIAZOLIDINE 1,1-DIOXIDE
[CAS]

5823-51-8
[Synonyms]

[1,2,5]THIADIAZOLIDINE 1,1-DIOXIDE
[Molecular Formula]

C2H6N2O2S
[MDL Number]

MFCD04037174
[MOL File]

5823-51-8.mol
[Molecular Weight]

122.15
Chemical PropertiesBack Directory
[Melting point ]

171-172 °C
[Boiling point ]

233.5±23.0 °C(Predicted)
[density ]

1.398
[storage temp. ]

Sealed in dry,Room Temperature
[pka]

12.39±0.20(Predicted)
[Appearance]

White to off-white Solid
[InChI]

InChI=1S/C2H6N2O2S/c5-7(6)3-1-2-4-7/h3-4H,1-2H2
[InChIKey]

ADBZIZGMAVRJPN-UHFFFAOYSA-N
[SMILES]

S1(=O)(=O)NCCN1
Safety DataBack Directory
[Symbol(GHS) ]

Exclamation Mark (GHS07)
GHS07
[Signal word ]

Warning
[Hazard statements ]

H302-H315-H319-H335
[Precautionary statements ]

P261-P305+P351+P338
Spectrum DetailBack Directory
[Spectrum Detail]

[1,2,5]THIADIAZOLIDINE 1,1-DIOXIDE(5823-51-8)1HNMR
Hazard InformationBack Directory
[Synthesis]

2-BENZYL-[1,2,5]THIADIAZOLIDINE 1,1-DIOXIDE

144432-72-4

[1,2,5]THIADIAZOLIDINE 1,1-DIOXIDE

5823-51-8

General procedure for the synthesis of 1,2,5-thiadiazolidine 1,1-dioxide from 2-benzyl-1Λ~6~,2,5-thiadiazolidine-1,1-dione: A mixture of 2-benzyl-1,2,5-thiadiazolidine-1,1-dioxide (1.000 g, 4.7 mmol) with 20% palladium hydroxide (0.200 g) in methanol (20 mL) was placed under hydrogen atmosphere (1 atm) and stirred for 16 hours. Upon completion of the reaction, the mixture was filtered through diatomaceous earth and the filtrate was concentrated to afford the white solid product 1,2,5-thiadiazolidine-1,1-dioxide (0.570 g, 99% yield). The product was characterized by 1H NMR (300 MHz, d6-DMSO): δ 6.68 (s, 2H), 3.30-3.25 (m, 4H).

[References]

[1] Patent: US2013/303524, 2013, A1. Location in patent: Paragraph 0437-0438
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