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CS-W001157 4
Total: USD 88.00

tert-Butyl methyl(4-oxocyclohexyl)carbamate

  • CAS No. 400899-84-5

  • Cat. No. CS-W003579
  • Purity≥97%
  • MDL No.MFCD09037870
  • 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 methyl(4-oxocyclohexyl)carbamate|CS-W003579

Structure of 400899-84-5

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Description

tert-Butyl methyl(4-oxocyclohexyl)carbamate features a sterically hindered tert-butyl carbamate protecting group paired with a methylated cyclohexanone-derived scaffold. This configuration enhances stability during synthetic manipulations while enabling selective deprotection under mild acidic conditions. The molecule integrates seamlessly into complex molecular architectures requiring robust protection and controlled release.

Application

tert-Butyl methyl(4-oxocyclohexyl)carbamate serves as a versatile building block in synthetic organic chemistry, enabling the efficient construction of functionalized cyclohexane scaffolds. The carbamate group provides robust protection for primary amines under standard reaction conditions, while the 4-oxo substituent offers a site for selective transformations such as reduction, nucleophilic addition, or enolate formation. Its bench-stable nature and compatibility with diverse coupling and functionalization protocols make it well-suited for medicinal chemistry and process development workflows.

General Information

  • CAS No. 400899-84-5
  • Cat. No. CS-W003579
  • Purity ≥97%
  • MDL No. MFCD09037870
  • Storage Store at room temperature
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₂H₂₁NO₃
  • Molecular Weight 227.30
  • Synonym(s) Carbamic acid, methyl(4-oxocyclohexyl)-, 1,1-dimethylethyl ester
  • SMILES CN(C(=O)OC(C)(C)C)C1CCC(=O)CC1

Computational Chemistry Data

  • TPSA   46.61
  • LogP   2.365
  • 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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