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CS-W001157 4
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3-Chloro-2-methoxyaniline

  • CAS No. 51114-68-2

  • Cat. No. CS-W014291
  • Purity≥98%
  • MDL No.MFCD00060607

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

3-Chloro-2-methoxyaniline|CS-W014291

Structure of 51114-68-2

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General Information

  • CAS No. 51114-68-2
  • Cat. No. CS-W014291
  • Purity ≥98%
  • MDL No. MFCD00060607
  • Storage 4°C, protect from light
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₇H₈ClNO
  • Molecular Weight 157.60
  • Synonym(s) 3-chloro-2-methoxy-aniline
  • SMILES NC1=CC=CC(Cl)=C1OC

Description

3-Chloro-2-methoxyaniline features a chlorinated aromatic ring paired with a methoxy group in the ortho position, delivering enhanced electron density and improved solubility in polar organic solvents. This configuration supports efficient coupling reactions in pharmaceutical synthesis and enables selective functionalization under mild conditions.

Application

3-Chloro-2-methoxyaniline serves as a versatile building block in medicinal chemistry and agrochemical synthesis, enabling efficient access to substituted heterocycles via electrophilic aromatic substitution or Suzuki-Miyaura coupling. The ortho-methoxy group enhances nucleophilicity at the adjacent position, while the chloro substituent provides a reliable handle for palladium-catalyzed transformations. Bench-stable and readily purified by column chromatography, it functions effectively in multi-step syntheses requiring functional group compatibility and predictable reactivity patterns.

Safety Information

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GHS Pictogram :
GHS No : GHS07
Signal Word : Warning
UN#: N/A
Class : N/A
Packing Group : N/A
Hazard Statements : H315-H319-H335
Precautionary Statements : P261-P264-P271-P280-P302+P352-P304+P340-P362+P364-P405-P501

Quality Control

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Computational Chemistry Data

  • TPSA   35.25
  • LogP   1.9308
  • H_Acceptors   2
  • H_Donors   1
  • Rotatable_Bonds   1

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