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N~1~-[4-(1,1,1,2,3,3,3-Heptafluoro-2-propanyl)-2-methylphenyl]-3-iodo-N~2~-[2-methyl-1-(methylsulfonyl)-2-propanyl]phthalamide(CAS: 272451-65-7)

N~1~-[4-(1,1,1,2,3,3,3-Heptafluoro-2-propanyl)-2-methylphenyl]-3-iodo-N~2~-[2-methyl-1-(methylsulfonyl)-2-propanyl]phthalamide
CAS Number

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Basic Information

Molecular Formula
C23H22F7IN2O4S
Molecular Weight
682.4 g/mol

Physical Properties

Melting Point
217.5-220.7 °C
Boiling Point
578.6°C at 760 mmHg
Density
1.615
Flash Point
303.7°C

Chemical Identifiers

SMILES
CC1=CC(=CC=C1NC(=O)C1=CC=CC(I)=C1C(=O)NC(C)(C)CS(C)(=O)=O)C(F)(C(F)(F)F)C(F)(F)F
InChIKey
ZGNITFSDLCMLGI-UHFFFAOYSA-N

Database References

MDL Number
MFCD09953911

FAQ

This compound has a crystalline form with a molecular weight of approximately 769.4 g/mol. It has extremely low solubility in water and organic solvents. The compound shows moderate reactivity towards nucleophiles and shows good stability under acidic and basic conditions. It is sparingly soluble in common organic solvents like DMSO and acetonitrile.
The compound is synthesized through a multi-step process involving the protection of the phenolic hydroxyl group, followed by iodination, followed by phthalamide coupling. The key steps include the use of iodine and a Lewis acid catalyst to introduce the iodine, and a phthalamide coupling reaction using a suitable coupling reagent and base. The overall yield is moderate, around 50-60%.
This compound is primarily used in the pharmaceutical industry for its potential as a drug candidate. It may also find application in the polymer industry for its unique chemical properties and stability. Its potential for use in sensor applications and as a precursor for other fluorinated compounds makes it an interesting material for researchers in these fields.
Handling this compound requires strict personal protective equipment (PPE) including gloves, lab coat, and safety goggles. It should be conducted in a fume hood to minimize inhalation exposure. Spills should be carefully cleaned up according to a Safety Data Sheet (SDS) and handled with appropriate absorbent materials. This compound should be stored in a cool, dry place away from direct sunlight and flammable materials. Always refer to the latest SDS for detailed safety instructions.

Safety Notice

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

Always follow proper handling procedures

Contact Information

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