1-(2-Fluorophenyl)-1-(4-fluorophenyl)-2-(1H-1,2,4-triazol-1-yl)ethanol | CAS No. 76674-21-0

1-(2-Fluorophenyl)-1-(4-fluorophenyl)-2-(1H-1,2,4-triazol-1-yl)ethanol

Basic Information

CAS Number

76674-21-0

Molecular Formula

C16H13F2N3O

Molecular Weight

301.3 g/mol

AD

Basic Physical Properties

Melting Point

130°

Density

1.3015 (estimate)

Flash Point

2 °C

OC(CN1C=NC=N1)(C1=CC=C(F)C=C1)C1=CC=CC=C1F

InChI

InChI=1S/C16H13F2N3O/c17-13-7-5-12(6-8-13)16(22,9-21-11-19-10-20-21)14-3-1-2-4-15(14)18/h1-8,10-11,22H,9H2

InChIKey

JWUCHKBSVLQQCO-UHFFFAOYSA-N

LogP

2.492400000000001

Topological Polar Surface Area

50.94 Ų

Hydrogen Bond Donor/Acceptor

1 / 4

Safety Information

View Safety Information

GHS Hazard Pictograms

H302H302

Hazard Statement

H302 Harmful if swallowed
Acute toxicity, oral

Stability

Stable. Incompatible with strong oxidizing agents.

Toxicity

LD50 male, female rats (mg/kg): 1140, 1480 orally; rats, rabbits: >1000, >2000 percutaneously (Skidmore)

Synonyms & References

English

  • flutriafol
  • (RS)-2,4-difluoro-α-(1H-1,2,4-triazol-1-ylmethyl)benzhydryl alcohol
  • (RS)2,4'- difluoro-α-(1H-1,2,4-triazol-1-yl methyl)dibenzhyryl alcohol
  • flutriafo
  • PP-450
  • (RS)-2,4'-difiuoro-a-(1H-1,2,4-triazol-l-ylmethyl)benzhyrylalcohol
  • alpha-(2-Fluorophenyl)-alpha-(4-fluorophenyl)-1H-1,2,4-triazole-1-ethanol
  • 1-(2-fluorophenyl)-1-(4-fluorophenyl)-2-(1,2,4-triazol-1-yl)ethanol
  • Flutriafol Solution
  • (RS)-2,4’-difluoro-α-(1H-1,2,4-triazol-1-ylmethyl)benzhydryl alcohol
  • flutriafen
  • IMPACT SOPRA
  • PP 450
  • rac-(1R)-1-(2-fluorophenyl)-1-(4-fluorophenyl)-2-(1H-1,2,4-triazol-1-yl)ethan-1-ol
  • α-(2-fluorophenyl)-α-(4-fluorophenyl)-1H-1,2,4-triazole-1-ethanol
  • (RS)-1-(2-Fluorophenyl)-1-(4-fluorophenyl)-2-(1H-1,2,4-triazol-1-yl)ethanol

MDL Number

MFCD00144319

Customs Code

2933990015

FAQ

What is 1-(2-Fluorophenyl)-1-(4-fluorophenyl)-2-(1H-1,2,4-triazol-1-yl)ethanol (CAS: 76674-21-0)?

1-(2-Fluorophenyl)-1-(4-fluorophenyl)-2-(1H-1,2,4-triazol-1-yl)ethanol (CAS: 76674-21-0) is a substituted ethanol compound featuring two fluorophenyl groups and a 1H-1,2,4-triazole ring. Its chemical formula is C14H10F2N4O, and it exhibits aromatic and heterocyclic characteristics. The molecule is commonly used in pharmaceutical research as a building block for drug development due to its potential biological activity. It is typically a solid at room temperature and may have limited solubility in water, requiring careful handling in organic solvents.

What are the main uses of 1-(2-Fluorophenyl)-1-(4-fluorophenyl)-2-(1H-1,2,4-triazol-1-yl)ethanol (CAS: 76674-21-0)?

This compound is primarily utilized in pharmaceutical applications, particularly in the development of drugs targeting specific biological pathways. It serves as a key intermediate in medicinal chemistry for synthesizing compounds with antiviral or anti-inflammatory properties. Additionally, it is employed in research settings for studying receptor interactions and as a component in chemical synthesis for creating complex molecules. Its versatility makes it valuable in both industrial and academic contexts.

Is 1-(2-Fluorophenyl)-1-(4-fluorophenyl)-2-(1H-1,2,4-triazol-1-yl)ethanol (CAS: 76674-21-0) safe?

Safety data for 1-(2-Fluorophenyl)-1-(4-fluorophenyl)-2-(1H-1,2,4-triazol-1-yl)ethanol (CAS: 76674-21-0) is limited, but it is generally considered hazardous due to its chemical structure. Precautions include wearing protective gloves, goggles, and lab coats when handling. It should be used in well-ventilated areas to avoid inhalation risks. Always follow established safety protocols and consult specific toxicological data for accurate risk assessment in industrial or research environments.

How should 1-(2-Fluorophenyl)-1-(4-fluorophenyl)-2-(1H-1,2,4-triazol-1-yl)ethanol (CAS: 76674-21-0) be stored?

This compound should be stored in a cool, dry place, ideally at 2-8°C, to maintain stability. It is sensitive to moisture and light, so storage in airtight containers with desiccant packs and in darkness is recommended. Avoid exposure to heat sources and incompatible materials. Proper labeling and storage in a secure chemical storage area are essential to ensure safety and prevent degradation over time.

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