METHYL 4-(1H-PYRAZOL-1-YLMETHYL)BENZOATE

Base Information

• Chemical Name: METHYL 4-(1H-PYRAZOL-1-YLMETHYL)BENZOATE
• CAS No.: 397328-86-8
• Molecular Formula: C12H12 N2 O2
• Molecular Weight: 216.239
• Hs Code.: 2933199090
• Mol file: 397328-86-8.mol

Synonyms:4-(1H-Pyrazol-1-ylmethyl)benzoicacid methyl ester; Methyl 4-[(1H-pyrazol-1-yl)methyl]benzoate

Chemical Property of METHYL 4-(1H-PYRAZOL-1-YLMETHYL)BENZOATE

Chemical Property:

• Vapor Pressure: 0mmHg at 25°C
• Melting Point: 45 °C
• Boiling Point: 373.2°Cat760mmHg
• Flash Point: 179.5°C
• PSA: 44.12000
• Density: 1.15g/cm³
• LogP: 1.71800

Purity/Quality:

98% ^*data from raw suppliers

methyl4-(1H-pyrazol-1-ylmethyl)benzoate ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

Technology Process of METHYL 4-(1H-PYRAZOL-1-YLMETHYL)BENZOATE

There total 2 articles about METHYL 4-(1H-PYRAZOL-1-YLMETHYL)BENZOATE which guide to synthetic route it. The literature collected by LookChem mainly comes from the sharing of users and the free literature resources found by Internet computing technology. We keep the original model of the professional version of literature to make it easier and faster for users to retrieve and use. At the same time, we analyze and calculate the most feasible synthesis route with the highest yield for your reference as below:

synthetic route:

Reference yield: 86.0%

NH-pyrazole (288-13-1) + Methyl 4-(bromomethyl)benzoate (2417-72-3) → methyl 4-((1H-pyrazol-1-yl)methyl)benzoate (397328-86-8)

Guidance literature:

NH-pyrazole; With potassium tert-butylate; In N,N-dimethyl-formamide; at 0 ℃; for 0.25h; Inert atmosphere;

Methyl 4-(bromomethyl)benzoate; In N,N-dimethyl-formamide; at 70 ℃; for 2h;

DOI:10.1021/acschemneuro.8b00600

Reference yield: 81.0%

→ methyl 4-((1H-pyrazol-1-yl)methyl)benzoate (397328-86-8)

Guidance literature:

Reference yield: 86.0%

methyl 4-((1H-pyrazol-1-yl)methyl)benzoate (397328-86-8) → (4-((1H-pyrazol-1-yl)methyl)phenyl)methanol (160388-55-6)

Guidance literature:

With lithium aluminium tetrahydride; In tetrahydrofuran; at 0 ℃; for 2h;

upstream raw materials:

NH-pyrazole

Methyl 4-(bromomethyl)benzoate

Downstream raw materials:

4-(1H-pyrazol-1-ylmethyl)benzoic acid

(R)-tert-butyl 3-(4-((1H-pyrazol-1-yl)methyl)-N-methylbenzamido)pyrrolidine-1-carboxylate

N-methyl-4-(1H-pyrazol-1-ylmethyl)-N-[(3R)-pyrrolidin-3-yl]benzamide

(4-((1H-pyrazol-1-yl)methyl)phenyl)methanol

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