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CS-W001157 4
Total: USD 88.00

3-Fluoro-4-nitrobenzonitrile

  • CAS No. 218632-01-0

  • Cat. No. CS-W019367
  • Purity≥97%
  • MDL No.MFCD04973417
  • HazMat Fee +

    HazMat Fee

    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:

    The shipment is processed through FedEx Ground under the Limited Quantity option.

    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.

3-Fluoro-4-nitrobenzonitrile|CS-W019367

Structure of 218632-01-0

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Description

3-Fluoro-4-nitrobenzonitrile features a strategically positioned nitro group and fluorine substituent on the benzene ring, delivering enhanced electron-withdrawing character. This combination enables efficient coupling in cross-coupling reactions and facilitates incorporation into complex molecular architectures. The nitrile moiety provides a handle for further functionalization, while the compound exhibits stability under standard reaction conditions.

Application

3-Fluoro-4-nitrobenzonitrile serves as a versatile building block in medicinal chemistry and agrochemical synthesis, enabling direct introduction of fluorine, nitro, and nitrile functionalities into complex molecular architectures. Its reactivity profile supports nucleophilic aromatic substitution, palladium-catalyzed coupling reactions, and reduction sequences under standard conditions. The molecule exhibits good bench stability and facilitates efficient purification via crystallization or chromatography, making it suitable for scale-up and multi-step synthesis workflows.

General Information

  • CAS No. 218632-01-0
  • Cat. No. CS-W019367
  • Purity ≥97%
  • MDL No. MFCD04973417
  • Storage Store at room temperature
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₇H₃FN₂O₂
  • Molecular Weight 166.11
  • Synonym(s) 4-Cyano-2-fluoronitrobenzene
  • SMILES N#CC1=CC=C([N+]([O-])=O)C(F)=C1

Computational Chemistry Data

  • TPSA   66.93
  • LogP   1.60558
  • H_Acceptors   3
  • H_Donors   0
  • Rotatable_Bonds   1

Safety Information

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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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