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1-Cyclopropyl-4-nitro-1H-pyrazole is a chemical compound characterized by the formula C6H6N4O2. It is a nitro derivative of pyrazole, a five-membered aromatic heterocyclic compound known for its diverse applications in the chemical and pharmaceutical industries. The cyclopropyl group attached to the pyrazole ring endows this compound with unique reactivity and biological activity, while the nitro group allows for further chemical modifications, making it a versatile intermediate in the synthesis of complex organic molecules.

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  • 1240568-16-4 Structure
  • Basic information

    1. Product Name: 1-Cyclopropyl-4-nitro-1H-pyrazole
    2. Synonyms: 1-Cyclopropyl-4-nitro-1H-pyrazole;1H-Pyrazole, 1-cyclopropyl-4-nitro-
    3. CAS NO:1240568-16-4
    4. Molecular Formula: C6H7N3O2
    5. Molecular Weight: 153.13868
    6. EINECS: N/A
    7. Product Categories: N/A
    8. Mol File: 1240568-16-4.mol
  • Chemical Properties

    1. Melting Point: N/A
    2. Boiling Point: 303.0±15.0 °C(Predicted)
    3. Flash Point: N/A
    4. Appearance: /
    5. Density: 1 +-.0.1 g/cm3(Predicted)
    6. Refractive Index: N/A
    7. Storage Temp.: 2-8°C
    8. Solubility: N/A
    9. PKA: -0.85±0.12(Predicted)
    10. CAS DataBase Reference: 1-Cyclopropyl-4-nitro-1H-pyrazole(CAS DataBase Reference)
    11. NIST Chemistry Reference: 1-Cyclopropyl-4-nitro-1H-pyrazole(1240568-16-4)
    12. EPA Substance Registry System: 1-Cyclopropyl-4-nitro-1H-pyrazole(1240568-16-4)
  • Safety Data

    1. Hazard Codes: N/A
    2. Statements: N/A
    3. Safety Statements: N/A
    4. WGK Germany:
    5. RTECS:
    6. HazardClass: N/A
    7. PackingGroup: N/A
    8. Hazardous Substances Data: 1240568-16-4(Hazardous Substances Data)

1240568-16-4 Usage

Uses

Used in Pharmaceutical Industry:
1-Cyclopropyl-4-nitro-1H-pyrazole is utilized as a building block for the synthesis of various pharmaceuticals and agrochemicals. Its unique structure and reactivity make it a valuable intermediate in the development of new drugs and chemical compounds with potential therapeutic applications.
Used in Medicinal Chemistry and Drug Discovery:
1-Cyclopropyl-4-nitro-1H-pyrazole exhibits potential for further research and development in the field of medicinal chemistry and drug discovery. Its cyclopropyl and nitro groups can be exploited to create novel derivatives with improved pharmacological properties, enhancing the discovery of new therapeutic agents.
Used in Chemical Synthesis:
1-Cyclopropyl-4-nitro-1H-pyrazole serves as a versatile intermediate in chemical synthesis, particularly for the production of complex organic molecules. Its unique reactivity allows for the creation of a wide range of chemical compounds with various applications in different industries.

Check Digit Verification of cas no

The CAS Registry Mumber 1240568-16-4 includes 10 digits separated into 3 groups by hyphens. The first part of the number,starting from the left, has 7 digits, 1,2,4,0,5,6 and 8 respectively; the second part has 2 digits, 1 and 6 respectively.
Calculate Digit Verification of CAS Registry Number 1240568-16:
(9*1)+(8*2)+(7*4)+(6*0)+(5*5)+(4*6)+(3*8)+(2*1)+(1*6)=134
134 % 10 = 4
So 1240568-16-4 is a valid CAS Registry Number.

1240568-16-4Relevant articles and documents

FUSED PYRIMIDINE COMPOUNDS, COMPOSITIONS AND MEDICINAL APPLICATIONS THEREOF

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Paragraph 0208, (2021/04/02)

The present disclosure relates to a class of fused pyrimidine compounds of Formula I, their stereoisomers, tautomers, pharmaceutically acceptable salts, polymorphs, solvates, and hydrates thereof. The present disclosure also relates to a process of preparation of these fused pyrimidine compounds, and to pharmaceutical compositions containing them.

Synthetic method of JAK inhibitor

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Paragraph 0030-0032; 0034, (2020/11/26)

The invention discloses a synthesis method of a JAK inhibitor, which is characterized in that: 4-nitro pyrazole and 3-oxetanone are adopted as initial raw materials; a Chan-Lam coupling reaction is performed on the initial raw material 4-nitro pyrazole an

SULFONYLUREA DERIVATIVES AND USES THEREOF

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Paragraph 01449-01450, (2020/12/30)

The present disclosure relates to compounds of Formula (I) and to their prodrugs, pharmaceutically acceptable salts, pharmaceutical compositions, methods of use, and methods for their preparation. The compounds disclosed herein are useful for inhibiting the maturation of cytokines of the IL-1 family by inhibiting inflammasomes and may be used in the treatment of disorders in which inflammasome activity is implicated, such as inflammatory, autoinflammatory and autoimmune diseases and cancers.

BENZAMIDES OF PYRAZOLYL-AMINO-PYRIMIDINYL DERIVATIVES, AND COMPOSITIONS AND METHODS THEREOF

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Paragraph 00497, (2020/07/07)

Provided is a novel class of orally and/or topically available, selective and potent JAK inhibitors as safe and effective therapeutics against various diseases and disorders. More particularly, provided are pharmaceutical composition of these compounds and methods of their preparation and use thereof.

PYRROLO(PYRAZOLO)PYRIMIDINE DERIVATIVE AS LRRK2 INHIBITOR

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Paragraph 0165, (2020/11/23)

The present invention relates to a pyrrolo(pyrazolo)pyrimidine derivative having efficacy as an LRRK2 inhibitor, a preparation method therefor, and a pharmaceutical composition for preventing or treating degenerative brain diseases, containing the same.

INDOLINONE COMPOUNDS FOR USE AS MAP4K1 INHIBITORS

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Page/Page column 71-72, (2020/05/15)

The present disclosure is directed to compounds of formula (I) and pharmaceutically acceptable salts thereof, wherein ring A, ring C, X1, X2, L1, R1, R2, R3, R4, R5, R6, R7, m and n are as defined herein, which are useful as MAP4K1 inhibitors, processes for their preparation, pharmaceutical compositions comprising the compounds, and the use of the compounds or the compositions in the treatment or prevention of various diseases, conditions and/or disorders mediated by MAP4K1.

2-substituted parazoleamino-4-substituted amino-5-pyrimidine formamide compound, composition and application thereof

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Paragraph 0102-0105, (2019/04/10)

The invention relates to a series of new compounds as a JAK inhibitor, as well as compositions and applications thereof, and particularly provides a series of compounds (I) that have a strong JAK inhibiting activity, or stereisomers, geometrical isomers, tautomers, pharmaceutically acceptable salts, prodrugs, metabolites, isotope derivatives, and solvates, as well as medicine compositions comprising such compounds. The invention also discloses applications of the compounds or the medicine compositions in preparation of a medicine, which is used for treatment of autoimmune diseases or cancer.

SULPHONYL UREA DERIVATIVES AS NLRP3 INFLAMMASOME MODULATORS

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Paragraph 0911, (2019/07/13)

The present disclosure relates to compounds of Formula (I): (I) and to their pharmaceutically acceptable salts, pharmaceutical compositions, methods of use, and methods for their preparation. The compounds disclosed herein are useful for inhibiting the maturation of cytokines of the IL-1 family by inhibiting inflammasomes and may be used in the treatment of disorders in which inflammasome activity is implicated, such as inflammatory, autoinflammatory and autoimmune diseases and cancers.

Design and synthesis of novel pyrimidine analogs as highly selective, non-covalent BTK inhibitors

Kawahata, Wataru,Asami, Tokiko,Irie, Takayuki,Sawa, Masaaki

, p. 145 - 151 (2017/12/06)

BTK is a promising target for the treatment of multiple diseases such as B cell malignances, asthma, and rheumatoid arthritis. Here, we report the discovery of a series of novel pyrimidine analogs as potent, highly selective, non-covalent inhibitors of BTK. Compound 25d demonstrated higher affinity to an unactivated conformation of BTK that resulted in an excellent kinase selectivity. Compound 25d showed a good oral bioavailability in mice, and significantly inhibits the PCA reaction in mice.

Five-And-Six-Membered Heterocyclic Compound, And Preparation Method, Pharmaceutical Composition And Use Thereof

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Paragraph 0470; 0471, (2015/12/07)

A five-and-six-membered heterocyclic compound as represented by general formula I, pharmaceutically acceptable salt, metabolite, metabolic precursors or drug precursors thereof, preparation method, pharmaceutical composition, and use thereof; the five-and-six-membered heterocyclic compound has activity as a Janus kinase (JAK) inhibitor, and can be used to prepare drugs for treating diseases caused by the abnormal activity of kinase, such as cell proliferation diseases like cancer.

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