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CS-W001157 4
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2-Chloro-6-(trifluoromethyl)nicotinonitrile

  • CAS No. 386704-06-9

  • Cat. No. CS-W008691
  • Purity≥98%
  • MDL No.MFCD01862660
  • 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.

2-Chloro-6-(trifluoromethyl)nicotinonitrile|CS-W008691

Structure of 386704-06-9

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Description

2-Chloro-6-(trifluoromethyl)nicotinonitrile features a trifluoromethyl group that enhances electron deficiency and metabolic stability, while the cyano and chloro substituents enable direct functionalization in heterocyclic synthesis. This bench-stable building block integrates efficiently into pharmaceutical intermediates and agrochemical scaffolds under standard conditions.

Application

2-Chloro-6-(trifluoromethyl)nicotinonitrile serves as a versatile building block in medicinal chemistry, enabling the construction of bioactive heterocycles via palladium-catalyzed cross-coupling reactions. Its trifluoromethyl and nitrile groups provide strong electron-withdrawing character, enhancing reactivity in nucleophilic substitution and facilitating functionalization at the 2-position. The compound exhibits excellent bench stability and compatibility with standard synthetic protocols, making it ideal for modular synthesis of pharmaceutical intermediates.

General Information

  • CAS No. 386704-06-9
  • Cat. No. CS-W008691
  • Purity ≥98%
  • MDL No. MFCD01862660
  • Storage 4°C
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₇H₂ClF₃N₂
  • Molecular Weight 206.55
  • Synonym(s) None
  • SMILES N#CC1=C(Cl)N=C(C(F)(F)F)C=C1

Computational Chemistry Data

  • TPSA   36.68
  • LogP   2.62548
  • H_Acceptors   2
  • H_Donors   0
  • 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 : 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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