Cas no 944718-27-8 (3-bromo-2-cyclopropyl-pyridine)

3-bromo-2-cyclopropyl-pyridine structure
944718-27-8 structure
Product Name:3-bromo-2-cyclopropyl-pyridine
CAS No:944718-27-8
MF:C8H8BrN
MW:198.059821128845
MDL:MFCD23143907
CID:1089424
PubChem ID:57642609
Update Time:2025-11-04

3-bromo-2-cyclopropyl-pyridine Chemical and Physical Properties

Names and Identifiers

    • 3-Bromo-2-cyclopropylpyridine
    • XYNYKZSFFFJHQQ-UHFFFAOYSA-N
    • Pyridine, 3-bromo-2-cyclopropyl-
    • FCH2316782
    • AK140047
    • SY041201
    • AX8251346
    • 3-Bromo-2-cyclopropylpyridine (ACI)
    • 3-bromo-2-cyclopropyl-pyridine
    • 944718-27-8
    • DA-24061
    • AKOS022171985
    • SCHEMBL8233305
    • MFCD23143907
    • DTXSID30727394
    • AS-59765
    • bromocyclopropylpyridine
    • AC7391
    • MDL: MFCD23143907
    • Inchi: 1S/C8H8BrN/c9-7-2-1-5-10-8(7)6-3-4-6/h1-2,5-6H,3-4H2
    • InChI Key: XYNYKZSFFFJHQQ-UHFFFAOYSA-N
    • SMILES: BrC1C(C2CC2)=NC=CC=1

Computed Properties

  • Exact Mass: 196.98401g/mol
  • Monoisotopic Mass: 196.98401g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 1
  • Heavy Atom Count: 10
  • Rotatable Bond Count: 1
  • Complexity: 122
  • Covalently-Bonded Unit Count: 1
  • Defined Atom Stereocenter Count: 0
  • Undefined Atom Stereocenter Count : 0
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • Topological Polar Surface Area: 12.9
  • XLogP3: 2.1

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3-bromo-2-cyclopropyl-pyridine Production Method

Production Method 1

Reaction Conditions
1.1 Reagents: Potassium carbonate Catalysts: Dichloro[1,1′-bis(diphenylphosphino)ferrocene]palladium(II) dichloromethane addu… Solvents: Acetonitrile ,  Water ;  5 d, 80 °C
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Production Method 2

Reaction Conditions
1.1 Reagents: Potassium acetate Catalysts: [1,1′-Bis(diphenylphosphino)ferrocene]dichloropalladium Solvents: 1,4-Dioxane ;  2 h, 95 °C
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Production Method 3

Reaction Conditions
1.1 Catalysts: Tetrakis(triphenylphosphine)palladium Solvents: Tetrahydrofuran ;  rt; 1 h, 65 °C
1.2 Reagents: Potassium carbonate Solvents: Water ;  neutralized
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Production Method 4

Reaction Conditions
1.1 Reagents: Tripotassium phosphate Catalysts: Tricyclohexylphosphine ,  Palladium diacetate ;  100 °C
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Production Method 5

Reaction Conditions
1.1 Reagents: Sodium nitrite ,  Bromine ,  Hydrogen bromide Solvents: Water ;  -10 °C; < -10 °C; 18 h, rt
1.2 Reagents: Sodium hydroxide Solvents: Water ;  pH 11 - 12, rt
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Production Method 6

Reaction Conditions
1.1 Catalysts: Tetrakis(triphenylphosphine)palladium Solvents: Tetrahydrofuran ;  4 h, 70 °C
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Production Method 7

Reaction Conditions
1.1 Catalysts: Tetrakis(triphenylphosphine)palladium Solvents: Tetrahydrofuran ;  2 h, 65 °C
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Production Method 8

Reaction Conditions
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3-bromo-2-cyclopropyl-pyridine Raw materials

3-bromo-2-cyclopropyl-pyridine Preparation Products

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