1,4-Oxathiane-2,6-dione structure

1,4-Oxathiane-2,6-dione

1,4-oxathiane-2,6-dione

Also Known As: 1,4-Oxathiane-2,6-dione|Thiodiglycolic anhydride|Chloromethiuron|Thiodiglycolicanhydride|1,4-Oxathiane-2,6-dione #|2,2 -Thiobisacetic anhydride|KS-00000JOH|1-Oxa-4-thia-cyclohexan-2,6-dione|2,2'-Thiodiacetic acid anhydride|Thiodiglycolic anhydride, AldrichCPR|1,4-Oxathiin-2,6(3H,5H)-dione|CS-W013418|I14-99688|1,4-Oxathiane-2,6-dione; Thiodiacetic Acid Cyclic Anhydride; 2,2'-Thiodiglycolic Anhydride; 2,2'-Thiobisacetic Acid Cyclic Anhydride; NSC 147625|608-761-6

CAS: 3261-87-8
Molecular Formula C4H4O3S
Molecular Weight 131.98811 g/mol
LogP 0.4
Topological Polar Surface Area 68.7 Ų
Hydrogen Bond Donors 0
Hydrogen Bond Acceptors 4
Rotatable Bonds 0
Exact Mass 131.98811
Monoisotopic Mass 131.98811
Heavy Atoms 8
Complexity 117.0

Chemical Identifiers

CAS Number 3261-87-8
SMILES C1C(=O)OC(=O)CS1
InChIKey RIIUAPMWDSRBSH-UHFFFAOYSA-N

Patent-Derived Application Labels

Derived from 5 IPC patent classification(s) across the SureChEMBL global patent database.

Analytical Reagents (3 patents) Heterocyclic Building Blocks (8 patents) Organic Building Blocks (12 patents) Pharmaceutical Intermediates (6 patents) Plastic Additives (2 patents)

Product Overview

1,4-Oxathiane-2,6-dione (CAS 3261-87-8), with molecular formula C4H4O3S and molecular weight 131.98811 g/mol. IUPAC: 1,4-oxathiane-2,6-dione.

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Safety Data Sheet (MSDS / SDS) View the Laboratory Chemical Safety Summary (LCSS) on PubChem — includes GHS classifications, hazard statements, first aid measures, and handling precautions.
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