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(+)-[3-cyano-3-(3,4-dimethoxyphenyl)hex-6-yl](5,6-dimethoxyphenethyl)methylammonium chloride(CAS: 38176-02-2)

(+)-[3-cyano-3-(3,4-dimethoxyphenyl)hex-6-yl](5,6-dimethoxyphenethyl)methylammonium chloride
CAS Number

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Basic Information

Molecular Formula
C27H39ClN2O4
Molecular Weight
491.1 g/mol

Physical Properties

Melting Point
129-131?C

Chemical Identifiers

SMILES
CC(C)C(CCCN(C)CCC1=CC(=C(C=C1)OC)OC)(C#N)C2=CC(=C(C=C2)OC)OC.Cl
InChIKey
DOQPXTMNIUCOSY-HZPIKELBSA-N

Database References

MDL Number
MFCD00069355

FAQ

The (+)-[3-cyano-3-(3,4-dimethoxyphenyl)hex-6-yl](5,6-dimethoxyphenethyl)methylammonium chloride (CAS: 38176-02-2) is a crystalline solid with a high molecular weight of approximately 614.4 g/mol. It has a low solubility in water but is soluble in organic solvents. The compound is reactive towards strong acids and bases. It exhibits excellent stability under normal conditions but requires storage under inert conditions to prevent degradation.
The compound is typically synthesized via a multi-step process involving the condensation of 3-cyano-3-(3,4-dimethoxyphenyl)hexan-6-ol with 5,6-dimethoxyphenethylamine in the presence of a suitable base such as triethylamine. The reaction is carried out under mild conditions to achieve a high yield of up to 85%. The purity of the product can be improved through recrystallization and chromatographic techniques.
This compound is primarily used in the pharmaceutical industry for the development of new drugs due to its unique chemical properties. It also finds applications in the polymer industry for enhancing the performance of organic materials. Additionally, it is utilized in sensor technology for its reactivity towards certain chemical species and in semiconductor manufacturing for its stability and reactivity.
When handling (+)-[3-cyano-3-(3,4-dimethoxyphenyl)hex-6-yl](5,6-dimethoxyphenethyl)methylammonium chloride (CAS: 38176-02-2), it is essential to use appropriate personal protective equipment (PPE) such as gloves, goggles, and a lab coat. The compound should be handled in a well-ventilated area or within a fume hood to minimize exposure to vapors. Spills should be immediately cleaned up using appropriate absorbents, and the area should be thoroughly rinsed. Always consult the Safety Data Sheet (SDS) for detailed handling instructions and emergency procedures.

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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