3-(5-methylfuran-2-yl)-1-phenyl-1H-pyrazole-4-carbaldehyde

Base Information

• Chemical Name: 3-(5-methylfuran-2-yl)-1-phenyl-1H-pyrazole-4-carbaldehyde
• CAS No.: 210825-08-4
• Molecular Formula: C15H12N2O2
• Molecular Weight: 252.27
• Hs Code.: 2934999090
• DSSTox Substance ID: DTXSID60355967
• Wikidata: Q82135069
• ChEMBL ID: CHEMBL1489151
• Mol file: 210825-08-4.mol

Synonyms:210825-08-4;3-(5-methylfuran-2-yl)-1-phenyl-1H-pyrazole-4-carbaldehyde;3-(5-methyl-2-furyl)-1-phenyl-1H-pyrazole-4-carbaldehyde;3-(5-Methyl-furan-2-yl)-1-phenyl-1H-pyrazole-4-carbaldehyde;3-(5-methylfuran-2-yl)-1-phenylpyrazole-4-carbaldehyde;CBMicro_035237;Cambridge id 5862866;MLS001005629;SCHEMBL3635890;CHEMBL1489151;DTXSID60355967;HMS2727N24;MFCD01828983;STK281581;AKOS000122226;BS-35846;SMR000348974;BIM-0035425.P001;CS-0218497;EN300-01143;AG-690/33370039;J-013827;Z56756381;3-(5-Methyl-2-furyl)-1-phenyl-1H-pyrazole-4-carbaldehyde, AldrichCPR

Chemical Property of 3-(5-methylfuran-2-yl)-1-phenyl-1H-pyrazole-4-carbaldehyde

Chemical Property:

• Vapor Pressure: 3.91E-07mmHg at 25°C
• Boiling Point: 416.1°C at 760 mmHg
• Flash Point: 205.5°C
• PSA: 48.03000
• Density: 1.21g/cm³
• LogP: 3.25320
• XLogP3: 2.5
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 3
• Exact Mass: 252.089877630
• Heavy Atom Count: 19
• Complexity: 317

Purity/Quality:

99% ^*data from raw suppliers

3-(5-Methylfuran-2-yl)-1-phenyl-1H-pyrazole-4-carbaldehyde ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC1=CC=C(O1)C2=NN(C=C2C=O)C3=CC=CC=C3

Technology Process of 3-(5-methylfuran-2-yl)-1-phenyl-1H-pyrazole-4-carbaldehyde

There total 1 articles about 3-(5-methylfuran-2-yl)-1-phenyl-1H-pyrazole-4-carbaldehyde 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: 73.0%

N,N-dimethyl-formamide (68-12-2,33513-42-7) + N-[1-(5-Methyl-furan-2-yl)-eth-(E)-ylidene]-N'-phenyl-hydrazine → 3-(5-Methyl-2-furyl)-1-phenylpyrazole-4-carbaldehyde (210825-08-4)

Guidance literature:

With trichlorophosphate; 1.) below 10 deg C, 1 h, 2.) r.t., 1 h then 60 deg C, 2 h;

Reference yield: 80.0%

p-aminoethylbenzoate (94-09-7) + 3-(5-Methyl-2-furyl)-1-phenylpyrazole-4-carbaldehyde (210825-08-4) → 4-{[1-[3-(5-Methyl-furan-2-yl)-1-phenyl-1H-pyrazol-4-yl]-meth-(Z)-ylidene]-amino}-benzoic acid ethyl ester

Guidance literature:

In toluene; Heating;

DOI:10.1007/BF02508112

Reference yield: 79.0%

acetophenone (98-86-2) + 3-(5-Methyl-2-furyl)-1-phenylpyrazole-4-carbaldehyde (210825-08-4) → 3-[3-(5-methyl-furan-2-yl)-1-phenyl-1H-pyrazol-4-yl]-1-phenyl-propenone (303773-71-9)

Guidance literature:

With sodium hydroxide; In water; isopropyl alcohol; at 20 - 50 ℃; for 3.5h;

DOI:10.1023/A:1012442205046

upstream raw materials:

N,N-dimethyl-formamide

Downstream raw materials:

3-[3-(5-methyl-furan-2-yl)-1-phenyl-1H-pyrazol-4-yl]-1-phenyl-propenone

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