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CS-W001157 4
Total: USD 88.00

6-Methyl-3,6-diazabicyclo[3.1.1]heptane dihydrochloride

  • CAS No. 2231676-00-7

  • Cat. No. CS-0184060
  • Purity≥97%
  • MDL No.None
  • HazMat Fee +

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    If shipping is charged to your FedEx account, the HazMat fee will be billed directly by the courier. Otherwise, the fee will be included on your invoice. To help you avoid the HazMat fee, we can package a 5g order of a class 6.1 packing group I or II material as five separate 1g units, and a 100g order of any other dangerous good as four 25g units. This packaging adjustment will be made unless you instruct otherwise on your purchase order. Below, you will find the fee schedule from FedEx for handling hazardous materials.

    Type
    HazMat Fee
    Excepted Quantity $0.00
    FedEx Limited Quantities Ground $0.00
    Hazmat Ground shipping $50.00+
    Inaccessible (Haz class 6.1 or 9), Domestic $68.00+
    Accessible (Haz class 3, 4, 5 or 8), Domestic $158.00+
    Inaccessible (Haz class 6.1 or 9), International $108.00+
    Accessible (Haz class 3, 4, 5 or 8), International $238.00+

    An item is classified as a dangerous good if our website displays Hazardous Material (HazMat) information for it.

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*For research and further manufacturing use only, not for direct human use.

6-Methyl-3,6-diazabicyclo[3.1.1]heptane dihydrochloride|CS-0184060

Structure of 2231676-00-7

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Description

6-Methyl-3,6-diazabicyclo[3.1.1]heptane dihydrochloride is a sterically hindered, bench-stable nitrogen heterocycle featuring two basic nitrogen centers in a rigid bicyclic framework. This structure enables efficient coordination in catalytic systems and enhances solubility in polar solvents. The methyl substituent at the 6-position fine-tunes electronic properties and steric profile, improving selectivity in asymmetric synthesis. Its dihydrochloride form ensures high stability and ease of handling under standard laboratory conditions.

Application

6-Methyl-3,6-diazabicyclo[3.1.1]heptane dihydrochloride serves as a versatile, bench-stable nitrogen heterocycle enabling efficient transition metal catalysis and amine coupling reactions. Its rigid bicyclic structure confers high basicity and excellent functional group tolerance, facilitating use in Suzuki-Miyaura couplings, Buchwald-Hartwig aminations, and as a ligand scaffold in palladium-catalyzed transformations. The dihydrochloride salt form enhances solubility and handling, making it ideal for scalable synthetic workflows.

General Information

  • CAS No. 2231676-00-7
  • Cat. No. CS-0184060
  • Purity ≥97%
  • MDL No. None
  • Storage Store at room temperature, keep dry and cool
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₆H₁₄Cl₂N₂
  • Molecular Weight 185.09
  • Synonym(s) 6-Methyl-3,6-diaza-bicyclo[3.1.1]heptane dihydrochloride
  • SMILES CN1C2CNCC1C2.[H]Cl.[H]Cl

Computational Chemistry Data

  • TPSA   15.27
  • LogP   0.5059
  • H_Acceptors   2
  • H_Donors   1
  • Rotatable_Bonds   0

Safety Information

Download SDS
GHS Pictogram :
GHS No : GHS07
Signal Word : Warning
UN#: N/A
Class : N/A
Packing Group : N/A
Hazard Statements : H315-H319-H335
Precautionary Statements : P261-P264-P271-P280-P302+P352-P304+P340-P362+P364-P405-P501

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