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(1R,5S)-3-benzyl 6-tert-butyl 3,6-diazabicyclo[3.2.0]heptane-3,6-dicarboxylate is a bicyclic compound with a molecular formula of C19H27N2O4 and a molecular weight of 345.43 g/mol. It is a derivative of diazabicyclo[3.2.0]heptane, a bicyclic amine, and features two carboxylate groups. The presence of benzyl and tert-butyl groups in the compound suggests potential applications in organic synthesis, pharmaceuticals, or materials science. The stereochemistry of the compound is specified by the (1R,5S) configuration, which indicates the relative positions of substituents on the bicyclic core. (1R,5S)-3-benzyl 6-tert-butyl 3,6-diazabicyclo[3.2.0]heptane-3,6-dicarboxylate represents a unique structural motif with potential applications in various chemical and biological contexts.

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  • (1R,5S)-3-benzyl 6-tert-butyl 3,6-diazabicyclo[3.2.0]heptane-3,6-dicarboxylate

    Cas No: 370880-79-8

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  • 370880-79-8 Structure
  • Basic information

    1. Product Name: (1R,5S)-3-benzyl 6-tert-butyl 3,6-diazabicyclo[3.2.0]heptane-3,6-dicarboxylate
    2. Synonyms: (1R,5S)-3-benzyl 6-tert-butyl 3,6-diazabicyclo[3.2.0]heptane-3,6-dicarboxylate;3-benzyl 6-tert-butyl 3,6-diazabicyclo[3.2.0]heptane-3,6-dicarboxylate;O3-Benzyl O6-tert-butyl 3,6-diazabicyclo[3.2.0]heptane-3,6-dicarboxylate
    3. CAS NO:370880-79-8
    4. Molecular Formula: C18H24N2O4
    5. Molecular Weight: 332.39416
    6. EINECS: -0
    7. Product Categories: N/A
    8. Mol File: 370880-79-8.mol
  • Chemical Properties

    1. Melting Point: N/A
    2. Boiling Point: 446.5±28.0 °C(Predicted)
    3. Flash Point: N/A
    4. Appearance: /
    5. Density: 1.218±0.06 g/cm3(Predicted)
    6. Refractive Index: N/A
    7. Storage Temp.: N/A
    8. Solubility: N/A
    9. PKA: -0.84±0.20(Predicted)
    10. CAS DataBase Reference: (1R,5S)-3-benzyl 6-tert-butyl 3,6-diazabicyclo[3.2.0]heptane-3,6-dicarboxylate(CAS DataBase Reference)
    11. NIST Chemistry Reference: (1R,5S)-3-benzyl 6-tert-butyl 3,6-diazabicyclo[3.2.0]heptane-3,6-dicarboxylate(370880-79-8)
    12. EPA Substance Registry System: (1R,5S)-3-benzyl 6-tert-butyl 3,6-diazabicyclo[3.2.0]heptane-3,6-dicarboxylate(370880-79-8)
  • 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: 370880-79-8(Hazardous Substances Data)

370880-79-8 Usage

Uses

Used in Organic Synthesis:
(1R,5S)-3-benzyl 6-tert-butyl 3,6-diazabicyclo[3.2.0]heptane-3,6-dicarboxylate is used as a synthetic intermediate for the preparation of various organic compounds. Its unique structural features, including the bicyclic core and carboxylate groups, make it a versatile building block for the synthesis of complex molecules.
Used in Pharmaceutical Industry:
(1R,5S)-3-benzyl 6-tert-butyl 3,6-diazabicyclo[3.2.0]heptane-3,6-dicarboxylate is used as a potential pharmaceutical agent due to its unique structural features. The presence of the benzyl and tert-butyl groups may allow for the development of new drugs with novel mechanisms of action or improved pharmacokinetic properties.
Used in Materials Science:
(1R,5S)-3-benzyl 6-tert-butyl 3,6-diazabicyclo[3.2.0]heptane-3,6-dicarboxylate is used as a component in the development of new materials with specific properties. (1R,5S)-3-benzyl 6-tert-butyl 3,6-diazabicyclo[3.2.0]heptane-3,6-dicarboxylate's structural features may contribute to the creation of materials with unique mechanical, electronic, or optical properties, depending on the application.

Check Digit Verification of cas no

The CAS Registry Mumber 370880-79-8 includes 9 digits separated into 3 groups by hyphens. The first part of the number,starting from the left, has 6 digits, 3,7,0,8,8 and 0 respectively; the second part has 2 digits, 7 and 9 respectively.
Calculate Digit Verification of CAS Registry Number 370880-79:
(8*3)+(7*7)+(6*0)+(5*8)+(4*8)+(3*0)+(2*7)+(1*9)=168
168 % 10 = 8
So 370880-79-8 is a valid CAS Registry Number.

370880-79-8Relevant articles and documents

FUSED HETEROCYCLIC COMPOUNDS AS OREXIN RECEPTOR MODULATORS

-

, (2011/05/06)

Certain disubstituted 3,8-diaza-bicyclo[4.2.0]octane and 3,6-diazabicyclo [3.2.0]heptane are described, which are useful as orexin inhibitors. Such compounds may be useful in pharmaceutical compositions and methods for the treatment of diseased states, disorders, and conditions mediated by orexin activity, such as insomnia.

FUSED HETEROCYCLIC COMPOUNDS AS OREXIN RECEPTOR MODULATORS

-

, (2011/05/06)

Disubstituted 3,8-diaza-bicyclo[4.2.0]octane and 3,6-diazabicyclo [3.2.0]heptane compounds are described, which are useful as orexin receptor modulators. Such compounds may be useful in pharmaceutical compositions and methods for the treatment of diseased states, disorders, and conditions mediated by orexin activity, such as insomnia.

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