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2-[(1E,3E,5E)-5-(3,3-Dimethyl-1-octadecyl-1,3-dihydro-2H-indol-2-ylidene)-1,3-pentadien-1-yl]-3,3-dimethyl-1-octadecyl-3H-indolium perchlorate(CAS: 127274-91-3)

2-[(1E,3E,5E)-5-(3,3-Dimethyl-1-octadecyl-1,3-dihydro-2H-indol-2-ylidene)-1,3-pentadien-1-yl]-3,3-dimethyl-1-octadecyl-3H-indolium perchlorate
CAS Number

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Basic Information

Molecular Formula
C61H99ClN2O4
Molecular Weight
959.9 g/mol

Physical Properties

Boiling Point
°Cat760mmHg
Flash Point
°C

Chemical Identifiers

SMILES
CCCCCCCCCCCCCCCCCCN1C2=CC=CC=C2C(C1=CC=CC=CC3=[N+](C4=CC=CC=C4C3(C)C)CCCCCCCCCCCCCCCCCC)(C)C.[O-]Cl(=O)(=O)=O
InChIKey
ZQSBJPAQPRVNHU-UHFFFAOYSA-M

Database References

MDL Number
MFCD00216701

FAQ

This compound has a crystalline form with a molecular weight of approximately 1000 g/mol. It has low solubility in water but is soluble in organic solvents like chloroform. It is moderately reactive, particularly with nucleophiles. The compound shows stability under normal laboratory conditions but requires care when exposed to strong acids or bases.
The compound is synthesized via a multistep reaction involving the coupling of an indole derivative with an alkenyl halide in the presence of a Lewis acid catalyst. The reaction is carried out in an organic solvent under anhydrous conditions to achieve high yields. The product is then converted to its perchlorate salt using perchloric acid.
This compound has applications in the pharmaceutical industry for its potential use as a precursor in the synthesis of bioactive molecules. It also finds use in the polymer industry as a stabilizer. Additionally, it can be used in the development of sensitive sensors and as a dopant in semiconductor materials.
Handling should be done in a well-ventilated area or fume hood to avoid inhalation of dust or aerosols. Use appropriate personal protective equipment, including gloves, goggles, and a laboratory coat. Spills should be handled with care using absorbent materials and the appropriate cleaning agents. Always consult the Safety Data Sheet (SDS) for detailed handling and safety information.

Safety Notice

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

Always follow proper handling procedures

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