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METHYL 4-(1H-PYRAZOL-1-YLMETHYL)BENZOATE, a chemical compound with the molecular formula C14H14N2O2, is an ester specifically belonging to the benzoate class. It is formed through the reaction of benzoic acid and methanol, resulting in a white solid at room temperature that is soluble in organic solvents. Known for its role as a building block in the production of various biologically active compounds, it serves as an important intermediate in the synthesis of pharmaceuticals and agrochemicals.

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  • 397328-86-8 Structure
  • Basic information

    1. Product Name: METHYL 4-(1H-PYRAZOL-1-YLMETHYL)BENZOATE
    2. Synonyms: METHYL 4-(1H-PYRAZOL-1-YLMETHYL)BENZOATE;Methyl 4-(1H-pyrazol-1-ylmethyl)benzoate 97%
    3. CAS NO:397328-86-8
    4. Molecular Formula: C12H12N2O2
    5. Molecular Weight: 216.24
    6. EINECS: N/A
    7. Product Categories: N/A
    8. Mol File: 397328-86-8.mol
  • Chemical Properties

    1. Melting Point: 45 °C
    2. Boiling Point: 373.2°Cat760mmHg
    3. Flash Point: 179.5°C
    4. Appearance: /
    5. Density: 1.15g/cm3
    6. Vapor Pressure: 0mmHg at 25°C
    7. Refractive Index: 1.575
    8. Storage Temp.: N/A
    9. Solubility: N/A
    10. CAS DataBase Reference: METHYL 4-(1H-PYRAZOL-1-YLMETHYL)BENZOATE(CAS DataBase Reference)
    11. NIST Chemistry Reference: METHYL 4-(1H-PYRAZOL-1-YLMETHYL)BENZOATE(397328-86-8)
    12. EPA Substance Registry System: METHYL 4-(1H-PYRAZOL-1-YLMETHYL)BENZOATE(397328-86-8)
  • 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: 397328-86-8(Hazardous Substances Data)

397328-86-8 Usage

Uses

Used in Pharmaceutical Industry:
METHYL 4-(1H-PYRAZOL-1-YLMETHYL)BENZOATE is used as an intermediate in the synthesis of pharmaceuticals for its ability to contribute to the development of biologically active compounds. Its unique structure allows it to be a key component in creating new drugs with potential therapeutic applications.
Used in Agrochemical Industry:
In the agrochemical sector, METHYL 4-(1H-PYRAZOL-1-YLMETHYL)BENZOATE is utilized as an intermediate in the production of agrochemicals, specifically for its role in creating compounds that can be used in pest control and crop protection. Its chemical properties make it a valuable asset in developing effective and targeted agrochemical solutions.

Check Digit Verification of cas no

The CAS Registry Mumber 397328-86-8 includes 9 digits separated into 3 groups by hyphens. The first part of the number,starting from the left, has 6 digits, 3,9,7,3,2 and 8 respectively; the second part has 2 digits, 8 and 6 respectively.
Calculate Digit Verification of CAS Registry Number 397328-86:
(8*3)+(7*9)+(6*7)+(5*3)+(4*2)+(3*8)+(2*8)+(1*6)=198
198 % 10 = 8
So 397328-86-8 is a valid CAS Registry Number.
InChI:InChI=1/C12H12N2O2/c1-16-12(15)11-5-3-10(4-6-11)9-14-8-2-7-13-14/h2-8H,9H2,1H3

397328-86-8SDS

SAFETY DATA SHEETS

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

Version: 1.0

Creation Date: Aug 16, 2017

Revision Date: Aug 16, 2017

1.Identification

1.1 GHS Product identifier

Product name methyl 4-(pyrazol-1-ylmethyl)benzoate

1.2 Other means of identification

Product number -
Other names -

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:397328-86-8 SDS

397328-86-8Relevant articles and documents

Brain Penetrable Histone Deacetylase 6 Inhibitor SW-100 Ameliorates Memory and Learning Impairments in a Mouse Model of Fragile X Syndrome

Kozikowski, Alan P.,Shen, Sida,Pardo, Marta,Tavares, Maurício T.,Szarics, Dora,Benoy, Veronick,Zimprich, Chad A.,Kutil, Zsófia,Zhang, Guiping,Ba?inka, Cyril,Robers, Matthew B.,Van Den Bosch, Ludo,Eubanks, James H.,Jope, Richard S.

, p. 1679 - 1695 (2019/01/04)

Disease-modifying therapies are needed for Fragile X Syndrome (FXS), as at present there are no effective treatments or cures. Herein, we report on a tetrahydroquinoline-based selective histone deacetylase 6 (HDAC6) inhibitor SW-100, its pharmacological a

TRICYCLIC PYRAZOLOPYRIDINE COMPOUNDS

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Paragraph 0124, (2015/11/27)

In one aspect this invention relates generally to compounds of Formula I and sub-formulas thereof, or a tautomer of each thereof, a pharmaceutically acceptable salt of each thereof, or a pharmaceutically acceptable solvate of each of the foregoing, where

PYRAZOLOPYRIDINE PYRAZOLOPYRIMIDINE AND RELATED COMPOUNDS

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Paragraph 0265; 0266, (2015/11/25)

In one aspect this invention relates generally to compounds of Formula: and sub-formulas thereof, or a tautomer of each thereof, a pharmaceutically acceptable salt of each thereof, or a pharmaceutically acceptable solvate of each of the foregoing, where X1, L1, L3, and R3 are described herein.

THERAPEUTIC INHIBITORY COMPOUNDS

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Page/Page column 198, (2015/07/16)

The invention provides compounds of Formula I and Formula II: A-B-C-D-E-F-G-J (I) C-D-E-F-G-J (II) wherein A, B, C, D, E, F, G, and J have any of the values defined in the specification, and salts thereof. The compounds are useful for inhibiting plasma kallikrein, and for treating a disease or condition in an animal where inhibition of plasma kallikrein is indicated.

HDAC INHIBITORS AND THERAPEUTIC METHODS USING THE SAME

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Page/Page column 67, (2012/08/27)

Histone deacetylases inhibitors (HDACIs) and compositions containing the same are disclosed. Methods of treating diseases and conditions wherein inhibition of HDAC provides a benefit, like a cancer, a neurodegenerative disorder, a peripheral neuropathy, a neurological disease, traumatic brain injury, stroke, hypertension, malaria, an autoimmune disease, autism, autism spectrum disorders, and inflammation, also are disclosed.

Pyrrolidin-3-yl-N-methylbenzamides as potent histamine 3 receptor antagonists

Zhou, Dahui,Gross, Jonathan L.,Sze, Jean Y.,Adedoyin, Adedayo B.,Bowlby, Mark,Di, Li,Platt, Brian J.,Zhang, Guoming,Brandon, Nicholas,Comery, Thomas A.,Robichaud, Albert J.

scheme or table, p. 5957 - 5960 (2011/10/18)

On the basis of the previously reported benzimidazole 1,3′- bipyrrolidine benzamides (1), a series of related pyrrolidin-3-yl-N- methylbenzamides were synthesized and evaluated as H3 receptor antagonists. In particular, compound 32 exhibits pot

AZACYCLYLBENZAMIDE DERIVATIVES AS HISTAMINE-3 ANTAGONISTS

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Page/Page column 40, (2009/01/20)

The present invention provides a compound of formula I and the use thereof for the treatment of a central nervous system disorder related to or affected by the histamine-3 receptor

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