N-{2,4-Dichloro-5-[4-(difluoromethyl)-3-methyl-5-oxo-4,5-dihydro-1H-1,2,4-triazol-1-yl]phenyl}methanesulfonamide | CAS No. 122836-35-5

N-{2,4-Dichloro-5-[4-(difluoromethyl)-3-methyl-5-oxo-4,5-dihydro-1H-1,2,4-triazol-1-yl]phenyl}methanesulfonamide

Basic Information

CAS Number

122836-35-5

Molecular Formula

C11H10Cl2F2N4O3S

Molecular Weight

387.2 g/mol

AD

Basic Physical Properties

Melting Point

75-78°

Density

1.7200

Cc1nn(c(=O)n1C(F)F)c2cc(c(cc2Cl)Cl)NS(=O)(=O)C

InChI

InChI=1S/C11H10Cl2F2N4O3S/c1-5-16-19(11(20)18(5)10(14)15)9-4-8(17-23(2,21)22)6(12)3-7(9)13/h3-4,10,17H,1-2H3

InChIKey

OORLZFUTLGXMEF-UHFFFAOYSA-N

LogP

2.41582

pKa

6.56(at 25℃)

Topological Polar Surface Area

85.99000000000001 Ų

Hydrogen Bond Donor/Acceptor

1 / 7

Safety Information

View Safety Information

Toxicity

LD50 orally in rats: 2855 mg/kg; dermally in rabbits: >2000 mg/kg; LC50 (96 hr) in bluegill sunfish, rainbow trout (ppm): 92.8, >130 (Van Saun)

Synonyms & References

English

  • SULFENTRAZONE
  • f6285
  • FMC97285
  • n-(2,4-dichloro-5-(4-(difluoromethyl)-4,5-dihydro-3-methyl-5-oxo-1h-1,2,4-triazol-1-yl)phenyl)-methanesulfonamid
  • n-(2,4-dichloro-5-(4-(difluoromethyl)-4,5-dihydro-3-methyl-methanesulfonamid
  • CAPAZ
  • BORAL
  • Sulfentrazone Solution
  • 2’,4’-dichloro-5’-(4-difluoromethyl-4,5-dihydro-3-methyl-5-oxo-1H-1,2,4-triazol-1-yl)methanesulfonanilide
  • N-[2,4-dichloro-5-[4-(difluoromethyl)-3-methyl-5-oxo-1,2,4-triazol-1-yl]phenyl]methanesulfonamide
  • N-[2,4-dichloro-5-[4-(difluoromethyl)-4,5-dihydro-3-methyl-5-oxo-1H-1,2,4-triazol-1-yl]phenyl]methanesulfonamide
  • N-{2,4-dichloro-5-[4-(difluoromethyl)-3-methyl-5-oxo-4,5-dihydro-1H-1,2,4-triazol-1-yl]phenyl}methanesulfonamide
  • Sulfentraz
  • N-(2,4-Dichloro-5-(4-(difluoromethyl)-4,5-dihydro-3-methyl-5-oxo-1H-1,2,4-triazol-1-yl)phenyl)methanesulfonamide
  • AUTHORITY
  • Sulfentrazone standard
  • SULFENTRAZONE,FMC 97285
  • FREE SAMPLE NCV SULFENTRAZONE TECHNICAL
  • 4-triazol-1-yl)phenyl)-5-oxo-1h-2
  • N-(2,4-dichloro-5-(4-(difluoromethyl)-3-methyl-5-oxo-4,5-dihydro-1H-1,2,4-triazol-1-yl)phenyl)methanesulfonamide

MDL Number

MFCD00869633

FAQ

What is N-{2,4-Dichloro-5-[4-(difluoromethyl)-3-methyl-5-oxo-4,5-dihydro-1H-1,2,4-triazol-1-yl]phenyl}methanesulfonamide (CAS: 122836-35-5)?

N-{2,4-Dichloro-5-[4-(difluoromethyl)-3-methyl-5-oxo-4,5-dihydro-1H-1,2,4-triazol-1-yl]phenyl}methanesulfonamide is a synthetic organic compound with the CAS number 122836-35-5. It contains a methanesulfonamide group attached to a substituted phenyl ring, which is further functionalized with a triazolyl group. The compound is known for its chemical stability and is often used in research and development settings. It exhibits moderate solubility in polar solvents and is typically a solid at room temperature.

What are the main uses of N-{2,4-Dichloro-5-[4-(difluoromethyl)-3-methyl-5-oxo-4,5-dihydro-1H-1,2,4-triazol-1-yl]phenyl}methanesulfonamide (CAS: 122836-35-5)?

N-{2,4-Dichloro-5-[4-(difluoromethyl)-3-methyl-5-oxo-4,5-dihydro-1H-1,2,4-triazol-1-yl]phenyl}methanesulfonamide (CAS: 122836-35-5) is primarily used in pharmaceutical research as a potential inhibitor of certain enzymes. It is also employed in the development of agrochemicals and as an intermediate in organic synthesis. Its unique chemical structure makes it valuable in the study of biological activities and drug design.

Is N-{2,4-Dichloro-5-[4-(difluoromethyl)-3-methyl-5-oxo-4,5-dihydro-1H-1,2,4-triazol-1-yl]phenyl}methanesulfonamide (CAS: 122836-35-5) safe?

The safety of N-{2,4-Dichloro-5-[4-(difluoromethyl)-3-methyl-5-oxo-4,5-dihydro-1H-1,2,4-triazol-1-yl]phenyl}methanesulfonamide (CAS: 122836-35-5) depends on its handling and exposure conditions. As a chemical compound, it may have potential toxicity if inhaled, ingested, or absorbed through the skin. Proper protective equipment, such as gloves and goggles, should be used when handling it. Safety data sheets (SDS) should be consulted for detailed information on its hazards and safe use protocols.

How should N-{2,4-Dichloro-5-[4-(difluoromethyl)-3-methyl-5-oxo-4,5-dihydro-1H-1,2,4-triazol-1-yl]phenyl}methanesulfonamide (CAS: 122836-35-5) be stored?

N-{2,4-Dichloro-5-[4-(difluoromethyl)-3-methyl-5-oxo-4,5-dihydro-1H-1,2,4-triazol-1-yl]phenyl}methanesulfonamide (CAS: 122836-35-5) should be stored in a cool, dry, and well-ventilated area, away from direct light. It is recommended to keep it in a sealed container to prevent moisture absorption. Storage conditions should maintain a temperature below 25°C and avoid exposure to incompatible substances to ensure stability and safety.

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