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CS-W001157 4
Total: USD 88.00

3-fluoro-4-(hydroxymethyl)benzonitrile

  • CAS No. 219873-06-0

  • Cat. No. CS-W001260
  • Purity≥96%
  • MDL No.MFCD09037779
  • 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.

3-fluoro-4-(hydroxymethyl)benzonitrile|CS-W001260

Structure of 219873-06-0

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Description

3-Fluoro-4-(hydroxymethyl)benzonitrile features a strategically positioned nitrile group and hydroxymethyl moiety on a fluorinated aromatic ring, enabling selective functionalization in medicinal chemistry. The electron-withdrawing fluorine enhances reactivity at the para-position, while the hydroxymethyl group offers a handle for derivatization under standard conditions. This scaffold supports rapid access to bioactive compounds in drug discovery workflows.

Application

3-Fluoro-4-(hydroxymethyl)benzonitrile serves as a versatile building block in medicinal chemistry, enabling efficient access to bioactive heterocycles and pharmaceutical intermediates. The nitrile group facilitates transformations such as amidation or reduction, while the hydroxymethyl function supports oxidation to carboxylic acid or derivatization via Mitsunobu reactions. Its fluorinated aromatic core enhances metabolic stability and modulates electronic properties, making it well-suited for drug discovery applications requiring precise functional group placement and synthetic flexibility.

General Information

  • CAS No. 219873-06-0
  • Cat. No. CS-W001260
  • Purity ≥96%
  • MDL No. MFCD09037779
  • Storage Store at room temperature
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₈H₆FNO
  • Molecular Weight 151.14
  • Synonym(s) 4-Cyano-2-fluorobenzyl alcohol
  • SMILES OCc1ccc(cc1F)C#N

Computational Chemistry Data

  • TPSA   44.02
  • LogP   1.18968
  • H_Acceptors   2
  • H_Donors   1
  • Rotatable_Bonds   1

Safety Information

Download SDS
GHS Pictogram :
GHS No : GHS05
Signal Word : Danger
UN#: 3261
Class : 8
Packing Group :
Hazard Statements : H318
Precautionary Statements : P260-P264-P280-P301+P330+P331-P303+P361+P353-P304+P340-P305+P351+P338-P363-P405-P501

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