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CS-W001157 4
Total: USD 88.00

(3-Fluoro-4-nitrophenyl)methanol

  • CAS No. 503315-74-0

  • Cat. No. CS-0043771
  • Purity≥98%
  • MDL No.MFCD03094236

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

(3-Fluoro-4-nitrophenyl)methanol|CS-0043771

Structure of 503315-74-0

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General Information

  • CAS No. 503315-74-0
  • Cat. No. CS-0043771
  • Purity ≥98%
  • MDL No. MFCD03094236
  • Storage Store at room temperature
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₇H₆FNO₃
  • Molecular Weight 171.13
  • Synonym(s) Structure
  • SMILES OCC1=CC=C([N+]([O-])=O)C(F)=C1

Description

(3-Fluoro-4-nitrophenyl)methanol features a fluorinated aromatic ring paired with a nitro group at the para position, enhancing electrophilicity and enabling selective functionalization. The benzylic alcohol moiety offers a handle for derivatization, while the molecule exhibits stability under standard bench conditions. This combination supports efficient integration into complex synthetic sequences.

Application

(3-Fluoro-4-nitrophenyl)methanol serves as a versatile building block in medicinal chemistry, enabling efficient access to fluorinated aromatic scaffolds. Its dual nitro and hydroxymethyl functionalities facilitate sequential transformations—nitro reduction followed by coupling or functionalization—while the fluorine substituent enhances metabolic stability and modulates electronic properties. Bench-stable and readily purified by column chromatography, it functions reliably in standard cross-coupling and reductive amination protocols.

Synthesis

  • Route1

    References

    • WO2009/39135 A1, ; Page/Page column 140 ;
  • Route2

    References

    • WO2004/58764 A1, ; Page 38 ; WO 2004/058764 A1

Safety Information

Download SDS
GHS Pictogram :
GHS No : GHS07
Signal Word : Warning
UN#: N/A
Class : N/A
Packing Group : N/A
Hazard Statements : H302-H315-H319-H335
Precautionary Statements : P261-P264-P270-P271-P280-P302+P352-P304+P340-P305+P351+P338-P330-P362+P364-P403+P233-P405-P501

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Computational Chemistry Data

  • TPSA   63.37
  • LogP   1.2262
  • H_Acceptors   3
  • H_Donors   1
  • Rotatable_Bonds   2

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