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CS-W001157 4
Total: USD 88.00

Ethyl 2-bromo-4-methylnicotinate

  • CAS No. 65996-17-0

  • Cat. No. CS-0103544
  • Purity≥97%
  • MDL No.MFCD16610942
  • HazMat Fee +

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    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.

Ethyl 2-bromo-4-methylnicotinate|CS-0103544

Structure of 65996-17-0

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Description

Ethyl 2-bromo-4-methylnicotinate is a brominated nicotinate ester featuring a methyl group at the 4-position and a reactive bromine at the 2-position. This configuration enables direct functionalization in cross-coupling reactions, particularly Suzuki-Miyaura and Negishi transformations. The molecule's electron-deficient pyridine ring enhances reactivity while maintaining bench-stable handling under standard conditions. It serves as a key intermediate in synthesizing bioactive heterocycles and pharmaceutical scaffolds.

Application

Ethyl 2-bromo-4-methylnicotinate serves as a versatile building block in heterocyclic synthesis, enabling palladium-catalyzed cross-coupling reactions due to its well-defined bromine functionality. The ester and methyl groups offer orthogonal handles for further derivatization, while the pyridine core provides stability and compatibility with standard reaction conditions. Its bench-stable nature and ease of purification make it ideal for iterative synthetic sequences in medicinal chemistry and process development.

General Information

  • CAS No. 65996-17-0
  • Cat. No. CS-0103544
  • Purity ≥97%
  • MDL No. MFCD16610942
  • Storage Store at room temperature
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₉H₁₀BrNO₂
  • Molecular Weight 244.09
  • Synonym(s) 2-Bromo-4-methyl-nicotinic acid ethyl ester
  • SMILES O=C(C1=C(C)C=CN=C1Br)OCC

Computational Chemistry Data

  • TPSA   39.19
  • LogP   2.32922
  • H_Acceptors   3
  • H_Donors   0
  • Rotatable_Bonds   2

Safety Information

Download SDS
GHS Pictogram :
GHS No : GHS06
Signal Word : Danger
UN#: 2810
Class : 6.1
Packing Group :
Hazard Statements : H301-H311-H331
Precautionary Statements : P261-P264-P270-P271-P280-P302+P352-P304+P340-P330-P361-P405-P501

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