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(2S,6'R)-7-Chloro-2',4,6-trimethoxy-6'-methyl-3H,4'H-spiro[1-benzofuran-2,1'-cyclohex[2]ene]-3,4'-dione(CAS: 126-07-8)

(2S,6'R)-7-Chloro-2',4,6-trimethoxy-6'-methyl-3H,4'H-spiro[1-benzofuran-2,1'-cyclohex[2]ene]-3,4'-dione
CAS Number

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Basic Information

Molecular Formula
C17H17ClO6
Molecular Weight
352.77 g/mol
Physical State
Powder

Physical Properties

Melting Point
218.0 to 222.0 deg-C
Boiling Point
527.9°C at 760 mmHg

Chemical Identifiers

SMILES
C[C@@H]1CC(=O)C=C([C@]12C(=O)c3c(cc(c(c3O2)Cl)OC)OC)OC
InChIKey
DDUHZTYCFQRHIY-RBHXEPJQSA-N

Database References

MDL Number
MFCD00082343
Beilstein Registry Number
95226

FAQ

This compound, with the CAS number 126-07-8, is a complex organic molecule featuring a spiro[1-benzofuran-2,1'-cyclohex[2]ene] framework. Its structure includes multiple methoxy (-OCH3) groups, a chloro (-Cl) substituent, and two ketone (C=O) functionalities. It is typically a solid with high molecular complexity, often used in specialized research and pharmaceutical applications due to its potential bioactivity and functional group versatility.
This compound is primarily used in pharmaceutical research as a potential lead molecule for drug development, particularly in antifungal and antitumor studies. It also serves as an intermediate in organic synthesis and is studied for its chemical reactivity and structural properties in academic and industrial laboratories.
Safety of this compound depends on handling and exposure conditions. It may exhibit toxicity if ingested or inhaled, necessitating protective measures like gloves, goggles, and ventilation. Always follow OSHA and EPA guidelines for chemical safety. Proper disposal and adherence to lab protocols are essential to minimize risks.
Store this compound in a cool, dry, and dark place (ideally 2-8°C) to prevent degradation. Use a sealed, airtight container to avoid moisture exposure. Protect from light using amber glass or aluminum containers. Maintain stable conditions to ensure chemical integrity and safety during storage.

Safety Notice

Please verify product specifications and safety data before use. Contact the supplier for detailed safety information.

Always follow proper handling procedures