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CS-W001157 4
Total: USD 88.00

2,4-Difluoro-3-methylbenzonitrile

  • CAS No. 847502-87-8

  • Cat. No. CS-W003421
  • Purity≥98%
  • MDL No.MFCD07777155
  • HazMat Fee +

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    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, except in the following scenarios:

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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.

2,4-Difluoro-3-methylbenzonitrile|CS-W003421

Structure of 847502-87-8

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Description

2,4-Difluoro-3-methylbenzonitrile features a trifunctional aromatic core with strategically positioned fluorine atoms and a methyl group that modulate electronic properties. The nitrile moiety provides a robust handle for downstream functionalization, while the electron-deficient ring enhances reactivity in cross-coupling processes. This bench-stable compound serves as a key building block in agrochemical and pharmaceutical synthesis.

Application

2,4-Difluoro-3-methylbenzonitrile serves as a versatile building block in medicinal chemistry, enabling the construction of fluorinated aromatic scaffolds via standard cross-coupling and electrophilic substitution reactions. Its regioselective substitution pattern and compatibility with palladium-catalyzed transformations facilitate efficient synthesis of complex heterocycles and API intermediates. The nitrile group provides a handle for downstream functionalization, while the methyl and difluoro substituents offer favorable electronic and steric profiles for target-directed design.

General Information

  • CAS No. 847502-87-8
  • Cat. No. CS-W003421
  • Purity ≥98%
  • MDL No. MFCD07777155
  • Storage Store at room temperature
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₈H₅F₂N
  • Molecular Weight 153.13
  • Synonym(s) 3-Cyano-2,6-difluorotoluene
  • SMILES CC1=C(F)C=CC(C#N)=C1F

Computational Chemistry Data

  • TPSA   23.79
  • LogP   2.1449
  • H_Acceptors   1
  • H_Donors   0
  • Rotatable_Bonds   0

Safety Information

Download SDS
GHS Pictogram :
GHS No : GHS06
Signal Word : Danger
UN#: 3439
Class : 6.1
Packing Group : Ⅲ
Hazard Statements : H302-H312-H315-H319-H331-H335
Precautionary Statements : P264-P270-P330-P405-P501

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