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CS-W001157 4
Total: USD 88.00

tert-Butyl 4-oxocyclohexanecarboxylate

  • CAS No. 38446-95-6

  • Cat. No. CS-0043135
  • Purity≥97%
  • MDL No.None
  • HazMat Fee +

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    Each bottle is packed as an Excepted Quantity, with a maximum of 1g for items in class 6.1 packing group I or II, and up to 25g for all other hazardous materials.

    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.

    There is a HazMat shipping fee for each item that qualifies as a dangerous good. Please contact our quotation team via email to confirm the details.

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

tert-Butyl 4-oxocyclohexanecarboxylate|CS-0043135

Structure of 38446-95-6

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Description

tert-Butyl 4-oxocyclohexanecarboxylate features a cyclohexanone ring with a strategically positioned ester group, enabling direct functionalization at the carbonyl-bearing carbon. This bench-stable ketone ester integrates readily into multistep syntheses, serving as a key intermediate for cyclic scaffolds in natural product and pharmaceutical development.

Application

tert-Butyl 4-oxocyclohexanecarboxylate serves as a versatile building block in synthetic organic chemistry, enabling efficient access to functionalized cyclohexane derivatives. The ketone and ester functionalities permit sequential transformations including enolate formation, nucleophilic additions, and reductive amination. Its bench-stable nature and straightforward purification make it ideal for multi-step synthesis of bioactive scaffolds and natural product intermediates.

General Information

  • CAS No. 38446-95-6
  • Cat. No. CS-0043135
  • Purity ≥97%
  • MDL No. None
  • Storage Store at room temperature
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₁H₁₈O₃
  • Molecular Weight 198.26
  • Synonym(s) tert-butyl 4-oxocyclohexane-1-carboxylate
  • SMILES O=C(C1CCC(CC1)=O)OC(C)(C)C

Computational Chemistry Data

  • TPSA   43.37
  • LogP   2.0874
  • H_Acceptors   3
  • H_Donors   0
  • Rotatable_Bonds   1

Safety Information

Download SDS
GHS Pictogram :
GHS No : GHS07
Signal Word : Warning
UN#: N/A
Class : N/A
Packing Group : N/A
Hazard Statements : H302-H315-H319-H335
Precautionary Statements : P261-P264-P270-P271-P280-P302+P352-P304+P340-P305+P351+P338-P330-P362+P364-P403+P233-P405-P501

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