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CS-W001157 4
Total: USD 88.00

(αS)-4-Bromo-2-fluoro-α-methylbenzenemethanamine

  • CAS No. 1228559-00-9

  • Cat. No. CS-0653354
  • Molecule weight218.07
  • Purity≥98%
  • MDL No.None

*For research and further manufacturing use only, not for direct human use.

(αS)-4-Bromo-2-fluoro-α-methylbenzenemethanamine|CS-0653354

Structure of 1228559-00-9

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General Information

  • CAS No. 1228559-00-9
  • Cat. No. CS-0653354
  • Purity ≥98%
  • MDL No. None
  • Storage 4°C, protect from light
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₈H₉BrFN
  • Molecular Weight 218.07
  • Synonym(s) None
  • SMILES C[C@@H](C1=C(C=C(C=C1)Br)F)N

Description

This chiral amine features a strategically positioned bromine and fluorine substituent on the aromatic ring, enabling selective functionalization in medicinal chemistry. The α-methyl group imparts stereochemical stability, while the amine handle facilitates conjugation in target-directed synthesis.

Application

(αS)-4-Bromo-2-fluoro-α-methylbenzenemethanamine serves as a valuable chiral building block for the synthesis of bioactive molecules, enabling stereoselective incorporation of fluorinated aryl motifs. Its functional group tolerance facilitates downstream coupling reactions, while the α-methyl substitution enhances metabolic stability. The compound exhibits good bench stability and is readily purified by standard chromatographic methods, making it well-suited for medicinal chemistry campaigns requiring fluorinated phenylalanine analogs.

Safety Information

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GHS Pictogram :
GHS No : GHS05
Signal Word : Danger
UN#: 2735
Class : 8
Packing Group : Ⅲ
Hazard Statements : H302-H315-H319-H335
Precautionary Statements : P261-P264-P270-P271-P280-P302+P352-P304+P340-P330-P362+P364-P405-P501

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Computational Chemistry Data

  • TPSA   26.02
  • LogP   2.6079
  • H_Acceptors   1
  • H_Donors   1
  • Rotatable_Bonds   1

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