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β-Cyano-β-Methyl-hydrocinnaMic Acid Ethyl Ester is an organic compound characterized by its yellow oil appearance. It is a derivative of hydrocinnamic acid, featuring a cyano group and a methyl group, which contribute to its unique chemical properties and potential applications.

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  • 123064-05-1 Structure
  • Basic information

    1. Product Name: β-Cyano-β-Methyl-hydrocinnaMic Acid Ethyl Ester
    2. Synonyms: β-Cyano-β-Methyl-hydrocinnaMic Acid Ethyl Ester
    3. CAS NO:123064-05-1
    4. Molecular Formula: C13H15NO2
    5. Molecular Weight: 217.2637
    6. EINECS: N/A
    7. Product Categories: Aromatics, Intermediates
    8. Mol File: 123064-05-1.mol
  • Chemical Properties

    1. Melting Point: N/A
    2. Boiling Point: 150-180 °C(Press: 10 Torr)
    3. Flash Point: N/A
    4. Appearance: /
    5. Density: 1.072±0.06 g/cm3(Predicted)
    6. Refractive Index: N/A
    7. Storage Temp.: N/A
    8. Solubility: N/A
    9. CAS DataBase Reference: β-Cyano-β-Methyl-hydrocinnaMic Acid Ethyl Ester(CAS DataBase Reference)
    10. NIST Chemistry Reference: β-Cyano-β-Methyl-hydrocinnaMic Acid Ethyl Ester(123064-05-1)
    11. EPA Substance Registry System: β-Cyano-β-Methyl-hydrocinnaMic Acid Ethyl Ester(123064-05-1)
  • Safety Data

    1. Hazard Codes: N/A
    2. Statements: N/A
    3. Safety Statements: N/A
    4. WGK Germany:
    5. RTECS:
    6. HazardClass: N/A
    7. PackingGroup: N/A
    8. Hazardous Substances Data: 123064-05-1(Hazardous Substances Data)

123064-05-1 Usage

Uses

Used in Pharmaceutical Industry:
β-Cyano-β-Methyl-hydrocinnaMic Acid Ethyl Ester is used as an intermediate compound for the preparation of CCR5 antagonists, which are crucial in the treatment of HIV-1. Its chemical structure allows it to interact with the CCR5 receptor, blocking the entry of the virus into host cells and thus playing a significant role in the development of antiretroviral therapies.
As a Yellow Oil:
The yellow oil form of β-Cyano-β-Methyl-hydrocinnaMic Acid Ethyl Ester can be utilized in various chemical reactions and processes due to its specific chemical properties. Its liquid state at room temperature makes it easier to handle and mix with other compounds, potentially leading to the creation of new pharmaceuticals or chemical products.

Check Digit Verification of cas no

The CAS Registry Mumber 123064-05-1 includes 9 digits separated into 3 groups by hyphens. The first part of the number,starting from the left, has 6 digits, 1,2,3,0,6 and 4 respectively; the second part has 2 digits, 0 and 5 respectively.
Calculate Digit Verification of CAS Registry Number 123064-05:
(8*1)+(7*2)+(6*3)+(5*0)+(4*6)+(3*4)+(2*0)+(1*5)=81
81 % 10 = 1
So 123064-05-1 is a valid CAS Registry Number.

123064-05-1Upstream product

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