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CS-W001157 4
Total: USD 88.00

Methyl 5-amino-2-fluoro-4-methoxybenzoate

  • CAS No. 1785259-87-1

  • Cat. No. CS-0160731
  • Molecule weight199.18
  • Purity≥98%
  • MDL No.MFCD23378835

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

Methyl 5-amino-2-fluoro-4-methoxybenzoate|CS-0160731

Structure of 1785259-87-1

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General Information

  • CAS No. 1785259-87-1
  • Cat. No. CS-0160731
  • Purity ≥98%
  • MDL No. MFCD23378835
  • Storage 4°C, protect from light
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₉H₁₀FNO₃
  • Molecular Weight 199.18
  • Synonym(s) 5-Amino-2-fluoro-4-methoxy-benzoic acid methyl ester
  • SMILES O=C(OC)C1=CC(N)=C(OC)C=C1F

Description

Methyl 5-amino-2-fluoro-4-methoxybenzoate features a fluorinated aromatic core with strategically positioned amino and methoxy groups, enabling facile functionalization in medicinal chemistry. This electron-rich scaffold integrates readily into complex heterocycles and serves as a key intermediate for bioactive compound synthesis under standard conditions.

Application

Methyl 5-amino-2-fluoro-4-methoxybenzoate serves as a versatile building block in medicinal chemistry, enabling the synthesis of fluorinated heterocycles and bioactive scaffolds. Its orthogonal functional groups—amino, fluoro, and methoxy—facilitate sequential transformations under mild conditions. The compound exhibits good bench stability and compatibility with standard coupling reactions, supporting efficient route optimization for API development.

Safety Information

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GHS Pictogram :
GHS No : GHS06
Signal Word : Danger
UN#: 2811
Class : 6.1
Packing Group : Ⅲ
Hazard Statements : H301-H311-H331
Precautionary Statements : P261-P264-P270-P271-P280-P302+P352-P304+P340-P330-P361-P405-P501

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Computational Chemistry Data

  • TPSA   61.55
  • LogP   1.2031
  • H_Acceptors   4
  • H_Donors   1
  • Rotatable_Bonds   2

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