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Methyl 3-chloro-1-Methyl-1H-pyrazole-5-carboxylate is a pyrazole derivative chemical compound characterized by the molecular formula C6H7ClN2O2. It features a chlorine atom and a methyl group attached to the pyrazole ring, which endows it with unique structural features and reactivity. Methyl 3-chloro-1-Methyl-1H-pyrazole-5-carboxylate is recognized for its potential in medicinal chemistry and drug development, making it a valuable component in the synthesis of pharmaceuticals and agrochemicals.

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  • 173841-06-0 Structure
  • Basic information

    1. Product Name: Methyl 3-chloro-1-Methyl-1H-pyrazole-5-carboxylate
    2. Synonyms: Methyl 3-chloro-1-Methyl-1H-pyrazole-5-carboxylate
    3. CAS NO:173841-06-0
    4. Molecular Formula: C6H7ClN2O2
    5. Molecular Weight: 174.58498
    6. EINECS: N/A
    7. Product Categories: N/A
    8. Mol File: 173841-06-0.mol
  • Chemical Properties

    1. Melting Point: 23-25 °C
    2. Boiling Point: 259.3±20.0 °C(Predicted)
    3. Flash Point: N/A
    4. Appearance: /
    5. Density: 1.37±0.1 g/cm3(Predicted)
    6. Refractive Index: N/A
    7. Storage Temp.: 2-8°C
    8. Solubility: N/A
    9. PKA: -2.04±0.10(Predicted)
    10. CAS DataBase Reference: Methyl 3-chloro-1-Methyl-1H-pyrazole-5-carboxylate(CAS DataBase Reference)
    11. NIST Chemistry Reference: Methyl 3-chloro-1-Methyl-1H-pyrazole-5-carboxylate(173841-06-0)
    12. EPA Substance Registry System: Methyl 3-chloro-1-Methyl-1H-pyrazole-5-carboxylate(173841-06-0)
  • 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: 173841-06-0(Hazardous Substances Data)

173841-06-0 Usage

Uses

Used in Pharmaceutical Synthesis:
Methyl 3-chloro-1-Methyl-1H-pyrazole-5-carboxylate is utilized as an intermediate in the production of various pharmaceuticals. Its specific structural attributes and reactivity make it a key component in the synthesis process, contributing to the development of new medications.
Used in Agrochemical Production:
In the agrochemical industry, Methyl 3-chloro-1-Methyl-1H-pyrazole-5-carboxylate serves as an essential intermediate. Its role in the synthesis of agrochemicals is crucial for creating effective products used in agriculture to protect crops and enhance yields.
Used as a Building Block in Organic Synthesis:
Beyond its applications in pharmaceuticals and agrochemicals, Methyl 3-chloro-1-Methyl-1H-pyrazole-5-carboxylate also functions as a versatile building block in organic synthesis. It is employed to construct a wide array of other compounds, expanding its utility across various chemical domains.
Used in Medicinal Chemistry and Drug Development:
Due to its structural features and reactivity, Methyl 3-chloro-1-Methyl-1H-pyrazole-5-carboxylate holds promise in the field of medicinal chemistry. It is explored for its potential to contribute to the discovery and development of new drugs, enhancing treatment options for various medical conditions.

Check Digit Verification of cas no

The CAS Registry Mumber 173841-06-0 includes 9 digits separated into 3 groups by hyphens. The first part of the number,starting from the left, has 6 digits, 1,7,3,8,4 and 1 respectively; the second part has 2 digits, 0 and 6 respectively.
Calculate Digit Verification of CAS Registry Number 173841-06:
(8*1)+(7*7)+(6*3)+(5*8)+(4*4)+(3*1)+(2*0)+(1*6)=140
140 % 10 = 0
So 173841-06-0 is a valid CAS Registry Number.

173841-06-0SDS

SAFETY DATA SHEETS

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

Version: 1.0

Creation Date: Aug 18, 2017

Revision Date: Aug 18, 2017

1.Identification

1.1 GHS Product identifier

Product name methyl 5-chloro-2-methylpyrazole-3-carboxylate

1.2 Other means of identification

Product number -
Other names METHYL 3-CHLORO-1-METHYL-1H-PYRAZOLE-5-CARBOXYLATE

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:173841-06-0 SDS

173841-06-0Downstream Products

173841-06-0Relevant articles and documents

Sulfamide-aryl amide type compound and medical application thereof in treatment of hepatitis B

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Paragraph 0312; 0313; 0317-0319, (2018/07/30)

The invention relates to a sulfamide-aryl amide type compound and the medical application thereof in treatment of hepatitis B, and specifically discloses a compound which can be treated as an HBV compound inhibitor and has the structure as shown in chemical formula (A), or a stereisomer, a cis-trans-isomer or a tautomer thereof, or pharmaceutically acceptable salt, aquo-complex or solvent compoundthereof; the identification of each group is shown in the description. The invention also relates to a medical composition containing the abovementioned compound and application thereof in treatmentof hepatitis B.

Compound for treatment on hepatitis B and use thereof

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Paragraph 0193; 0194; 0198; 0199; 0200, (2018/07/30)

The invention relates to a compound for treatment on hepatitis B and a use thereof. Specifically, the invention discloses a compound as a HBV replication inhibitor having the structure shown in the formula (A), or its stereoisomer, tautomer, pharmaceutically acceptable salt, hydrate or solvate. The groups are detailed in the specification. The invention also relates a pharmaceutical composition containing the compound and a use thereof in treatment on hepatitis B.

DISUBSTITUTED HETEROARYL-FUSED PYRIDINES

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Page/Page column 52, (2012/10/18)

The invention relates to compound of the formula (I′) in which the substituents are as defined in the specification; in free form or in salt form; to its preparation, to its use as medicament and to medicaments comprising it.

DISUBSTITUTED HETEROARYL-FUSED PYRIDINES

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Page/Page column 103, (2011/07/09)

The invention relates to compound of the formula (I') in which the substituents are as defined in the specification; in free form or in salt form; to its preparation, to its use as medicament and to medicaments comprising it.

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