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1002535-21-8

3-(1H-Pyrazol-4-yl)benzoic acid is a chemical compound characterized by the molecular formula C11H8N2O2. It belongs to the benzoic acid family and features a pyrazole ring, which endows it with unique structural and chemical properties. This versatile compound is recognized for its potential in pharmaceuticals and organic synthesis, serving as a building block for the creation of various bioactive molecules and pharmaceutical drugs. Its distinctive structure also makes it a valuable asset in chemical research for investigating the properties and reactivity of pyrazole-containing compounds.

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  • 1002535-21-8 Structure

  • Basic information

    1. Product Name: 3-(1H-PYRAZOL-4-YL)BENZOIC ACID
    2. Synonyms: AKOS B025040;AKOS BAR-1967;3-(1H-PYRAZOL-4-YL)BENZOIC ACID;ART-CHEM-BB B025040;CHEMBRDG-BB 4009800;3-(1H-pyrazol-4-yl)benzoic acid(SALTDATA: FREE);3-(1H-Pyrazol-4-yl)benzoicacid97%
    3. CAS NO:1002535-21-8
    4. Molecular Formula: C10H8N2O2
    5. Molecular Weight: 188.18
    6. EINECS: N/A
    7. Product Categories: Carboxylic Acids;Phenyls & Phenyl-Het;Carboxylic Acids;Phenyls & Phenyl-Het
    8. Mol File: 1002535-21-8.mol

  • Chemical Properties

    1. Melting Point: N/A
    2. Boiling Point: 498.5±38.0 °C(Predicted)
    3. Flash Point: N/A
    4. Appearance: /
    5. Density: 1.355±0.06 g/cm3(Predicted)
    6. Refractive Index: N/A
    7. Storage Temp.: N/A
    8. Solubility: N/A
    9. PKA: 4.06±0.10(Predicted)
    10. CAS DataBase Reference: 3-(1H-PYRAZOL-4-YL)BENZOIC ACID(CAS DataBase Reference)
    11. NIST Chemistry Reference: 3-(1H-PYRAZOL-4-YL)BENZOIC ACID(1002535-21-8)
    12. EPA Substance Registry System: 3-(1H-PYRAZOL-4-YL)BENZOIC ACID(1002535-21-8)

  • Safety Data

    1. Hazard Codes: Xn
    2. Statements: 22
    3. Safety Statements: N/A
    4. WGK Germany:
    5. RTECS:
    6. HazardClass: N/A
    7. PackingGroup: N/A
    8. Hazardous Substances Data: 1002535-21-8(Hazardous Substances Data)

1002535-21-8 Usage

Uses

Used in Pharmaceutical Industry:
3-(1H-Pyrazol-4-yl)benzoic acid is utilized as a key intermediate in the synthesis of pharmaceutical drugs. Its incorporation into drug molecules can enhance their bioactivity and therapeutic efficacy, making it an essential component in drug discovery and development processes.
Used in Organic Synthesis:
In the realm of organic chemistry, 3-(1H-Pyrazol-4-yl)benzoic acid serves as a versatile building block for the construction of complex organic molecules. Its unique pyrazole ring allows for a wide range of chemical reactions, facilitating the synthesis of novel compounds with diverse applications.
Used in Chemical Research:
3-(1H-Pyrazol-4-yl)benzoic acid is employed as a valuable tool in chemical research for studying the properties and reactivity of pyrazole-containing compounds. Its unique structure provides insights into the behavior of similar compounds, contributing to a deeper understanding of pyrazole chemistry and its applications in various fields.

Check Digit Verification of cas no

The CAS Registry Mumber 1002535-21-8 includes 10 digits separated into 3 groups by hyphens. The first part of the number,starting from the left, has 7 digits, 1,0,0,2,5,3 and 5 respectively; the second part has 2 digits, 2 and 1 respectively.
Calculate Digit Verification of CAS Registry Number 1002535-21:
(9*1)+(8*0)+(7*0)+(6*2)+(5*5)+(4*3)+(3*5)+(2*2)+(1*1)=78
78 % 10 = 8
So 1002535-21-8 is a valid CAS Registry Number.

1002535-21-8SDS

SAFETY DATA SHEETS

According to Globally Harmonized System of Classification and Labelling of Chemicals (GHS) - Sixth revised edition

Version: 1.0

Creation Date: Aug 10, 2017

Revision Date: Aug 10, 2017

1.Identification

1.1 GHS Product identifier

Product name 3-(1H-PYRAZOL-4-YL)BENZOIC ACID

1.2 Other means of identification

Product number -
Other names 3-pyrazol-4-ylbenzoic acid

1.3 Recommended use of the chemical and restrictions on use

Identified uses For industry use only.
Uses advised against no data available

1.4 Supplier's details

1.5 Emergency phone number

Emergency phone number -
Service hours Monday to Friday, 9am-5pm (Standard time zone: UTC/GMT +8 hours).

More Details:1002535-21-8 SDS

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