1-[(4-Nitrophenyl)sulfonyl]-1H-1,2,4-triazole

Basic Information

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CAS Number

57777-84-1

Molecular Formula

C8H6N4O4S

Molecular Weight

254.23 g/mol

Chemical Classification

Basic Chemical Raw Materials Organic Chemicals Carboxylic Acids

Basic Chemical Raw Materials Organic Chemicals Heterocyclic Compounds

Pharmaceutical Chemicals Pharmaceutical Intermediates Heterocyclic Intermediates

Fine Chemicals Dyes and Pigments Organic Dyes

Basic Physical Properties

Density

1.69

SMILES

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C1=CC(=CC=C1[N+](=O)[O-])S(=O)(=O)N2C=NC=N2

InChI

InChI=1S/C8H6N4O4S/c13-12(14)7-1-3-8(4-2-7)17(15,16)11-6-9-5-10-11/h1-6H

InChIKey

HMNOLKQVFZCVIW-UHFFFAOYSA-N

LogP

2.02730

Complexity

379

Synonyms & References

English

MFCD00079529
C8H6N4O4S
DTXSID20206461
1-(4-Nitrobenzenesulfonyl)-1H-1,2,4-triazole
57777-84-1
NS00033788
1-(4-Nitrobenzenesulfonyl)-1H-1,2,4-Triazole?
EINECS 260-946-7
1-((4-Nitrophenyl)sulphonyl)-1H-1,2,4-triazole
1-(4-nitrophenyl)sulfonyl-1,2,4-triazole
p-NBST
HMNOLKQVFZCVIW-UHFFFAOYSA-N
AS-20007
C93491
1-(4-Nitrophenylsulfonyl)-1,2,4-triazole
AC-14382
FT-0719712
1-((4-Nitrophenyl)sulfonyl)-1H-1,2,4-triazole
1-(4-Nitrophenylsulfonyl)-1H-1,2,4-triazole
1-[(4-nitrophenyl)sulfonyl]-1h-1,2,4-triazole
SY273356
SCHEMBL1096992
AKOS015833442
A869588
J-502820
1-(4-NITROBENZENESULFONYL)-1H-1,2,4-TRIAZOLE
1H-1,2,4-Triazole,1-[(4-nitrophenyl)sulfonyl]-
1-(4-nitro-benzenesulfonyl)-1H-[1,2,4]triazole
1-(p-nitrobenzenesulfonyl)-1H-1,2,4-triazole
1-(p-Nitrobenzolsulfonyl)-(1H)-1,2,4-triazol
1-[(4-nitrophenyl)sulfonyl]-1H-1,2,4-triazole

MDL Number

MFCD00079529

Customs Code

2933990090

FAQ

What regulatory guidelines apply to 1-[(4-Nitrophenyl)sulfonyl]-1H-1,2,4-triazole (CAS: 57777-84-1)?

1-[(4-Nitrophenyl)sulfonyl]-1H-1,2,4-triazole (CAS: 57777-84-1) falls under the scope of the GHS (Globally Harmonized System of Classification and Labelling of Chemicals) for hazardous substances. It is also regulated under the REACH (Registration, Evaluation, Authorization and Restriction of Chemicals) framework in the EU. FDA and EPA have specific requirements for its use in pharmaceutical and agricultural applications, respectively.

Are there alternatives to 1-[(4-Nitrophenyl)sulfonyl]-1H-1,2,4-triazole in synthesis (CAS: 57777-84-1)?

Several alternatives can be used in the synthesis of 1-[(4-Nitrophenyl)sulfonyl]-1H-1,2,4-triazole (CAS: 57777-84-1), such as 1-(phenylsulfonyl)-1H-1,2,4-triazole or 1-(2-nitrophenylsulfonyl)-1H-1,2,4-triazole. These compounds offer similar reactivity and can serve as efficient substitutes in various synthetic procedures.

What is the market or research trend for 1-[(4-Nitrophenyl)sulfonyl]-1H-1,2,4-triazole (CAS: 57777-84-1)?

The market for 1-[(4-Nitrophenyl)sulfonyl]-1H-1,2,4-triazole (CAS: 57777-84-1) is growing due to its applications in pharmaceuticals and agrochemicals. Research trends focus on developing its use in anticancer drugs and as a fungicide. The demand is expected to increase with ongoing advancements in synthetic chemistry and medicinal applications.

How should waste containing 1-[(4-Nitrophenyl)sulfonyl]-1H-1,2,4-triazole (CAS: 57777-84-1) be handled?

Waste containing 1-[(4-Nitrophenyl)sulfonyl]-1H-1,2,4-triazole (CAS: 57777-84-1) should be collected in appropriate containers and stored separately to prevent contamination. Incineration is a common method for disposal, but professional waste disposal services should be utilized for safe handling. Environmental protection measures, such as proper air pollution control, should be adhered to during the process.