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CS-W001157 4
Total: USD 88.00

5-(Trifluoromethyl)-1H-pyrrole-2-carboxylic acid

  • CAS No. 1314400-72-0

  • Cat. No. CS-0037380
  • Purity≥98%
  • MDL No.None
  • 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.

5-(Trifluoromethyl)-1H-pyrrole-2-carboxylic acid|CS-0037380

Structure of 1314400-72-0

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Description

This trifluoromethyl-substituted pyrrole carboxylic acid features a strongly electron-deficient aromatic core, enhancing its utility in cross-coupling reactions and as a building block for bioactive heterocycles. The carboxylic acid group enables direct derivatization or metal complexation, while the trifluoromethyl moiety imparts metabolic stability and modulates lipophilicity.

Application

5-(Trifluoromethyl)-1H-pyrrole-2-carboxylic acid serves as a versatile building block in medicinal chemistry, enabling the construction of bioactive heterocycles through standard coupling and functionalization reactions. Its trifluoromethyl group enhances metabolic stability and lipophilicity, while the carboxylic acid functionality facilitates direct amidation, esterification, or activation for peptide-like linkages. The compound exhibits good bench stability and compatibility with common synthetic protocols, making it suitable for iterative synthesis workflows in drug discovery programs.

General Information

  • CAS No. 1314400-72-0
  • Cat. No. CS-0037380
  • Purity ≥98%
  • MDL No. None
  • Storage 4°C
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₆H₄F₃NO₂
  • Molecular Weight 179.10
  • Synonym(s) 5-Trifluoromethyl-1H-Pyrrole-2-Carboxylic Acid
  • SMILES C1=C(C(=O)O)NC(=C1)C(F)(F)F

Computational Chemistry Data

  • TPSA   53.09
  • LogP   1.7317
  • H_Acceptors   1
  • H_Donors   2
  • 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-P280-P302+P352

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