(+)-[3-cyano-3-(3,4-dimethoxyphenyl)hex-6-yl](5,6-dimethoxyphenethyl)methylammonium chloride | CAS No. 38176-02-2

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

Basic Information

CAS Number

38176-02-2

Molecular Formula

C27H39ClN2O4

Molecular Weight

491.1 g/mol

AD

Basic Physical Properties

Melting Point

129-131?C

Solubility

H2O: >30mg/mL

CC(C)C(CCCN(C)CCC1=CC(=C(C=C1)OC)OC)(C#N)C2=CC(=C(C=C2)OC)OC.Cl

InChI

InChI=1S/C27H38N2O4.ClH/c1-20(2)27(19-28,22-10-12-24(31-5)26(18-22)33-7)14-8-15-29(3)16-13-21-9-11-23(30-4)25(17-21)32-6;/h9-12,17-18,20H,8,13-16H2,1-7H3;1H/t27-;/m1./s1

InChIKey

DOQPXTMNIUCOSY-HZPIKELBSA-N

LogP

0.43398

Complexity

606

Synonyms & References

English

  • NSC-632821
  • SCHEMBL8759750
  • DEXVERAPAMIL MONOHYDROCHLORIDE
  • (R)-Verapamil Hydrochloride
  • UNII-B0P742MK5O
  • Dexverapamil Hydrochloride
  • BENZENEACETONITRILE, .ALPHA.-(3-((2-(3,4-DIMETHOXYPHENYL)ETHYL)METHYLAMINO)PROPYL)-3,4-DIMETHOXY-.ALPHA.-(1-METHYLETHYL)-, MONOHYDROCHLORIDE, (.ALPHA.R)-
  • 38176-02-2
  • Q27147334
  • (+)-verapamil hydrochloride
  • CHEMBL1994739
  • (4R)-4-cyano-4-(3,4-dimethoxyphenyl)-N-[2-(3,4-dimethoxyphenyl)ethyl]-N,5-dimethylhexan-1-aminium chloride
  • (2R)-2-(3,4-dimethoxyphenyl)-5-[2-(3,4-dimethoxyphenyl)ethyl-methylamino]-2-propan-2-ylpentanenitrile;hydrochloride
  • (+)-(3-Cyano-3-(3,4-dimethoxyphenyl)hex-6-yl)(5,6-dimethoxyphenethyl)methylammonium chloride
  • VERAPAMIL (R)-FORM HYDROCHLORIDE [MI]
  • (2R)-2-(3,4-dimethoxyphenyl)-5-{[2-(3,4-dimethoxyphenyl)ethyl](methyl)amino}-2-isopropylpentanenitrile hydrochloride
  • Verapamil hydrochloride, (+)-
  • 2-(3,4-Dimethoxyphenyl)-5-{[2-(3,4-dimethoxyphenyl)ethyl](methyl)amino}-2-(propan-2-yl)pentanenitrile--hydrogen chloride (1/1)
  • CHEBI:77739
  • (+)-[3-cyano-3-(3,4-dimethoxyphenyl)hex-6-yl](5,6-dimethoxyphenethyl)methylammonium chloride
  • (R)-(+)-Verapamil Hydrochloride
  • NSC632821
  • B0P742MK5O
  • DTXSID80959103
  • HY-135336
  • R-Verapamil Hydrochloride from Knoll Pharma.
  • AKOS040736385
  • (2r)-2-(3,4-dimethoxyphenyl)-5-{[2-(3,4-dimethoxyphenyl)ethyl](methyl)amino}-2-(propan-2-yl)pentanenitrile hydrochloride(1:1)
  • dexverapamil.HCl
  • dexverapamil HCl
  • EINECS 253-810-3

MDL Number

MFCD00069355

FAQ

What are the physical and chemical properties of (+)-[3-cyano-3-(3,4-dimethoxyphenyl)hex-6-yl](5,6-dimethoxyphenethyl)methylammonium chloride (CAS: 38176-02-2)?

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.

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

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.

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

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.

What precautions should be taken when handling (+)-[3-cyano-3-(3,4-dimethoxyphenyl)hex-6-yl](5,6-dimethoxyphenethyl)methylammonium chloride (CAS: 38176-02-2)?

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.

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