3-(3-Methylthiophen-2-yl)-1-phenylprop-2-en-1-one

Base Information

• Chemical Name: 3-(3-Methylthiophen-2-yl)-1-phenylprop-2-en-1-one
• CAS No.: 77869-10-4
• Molecular Formula: C₁₄H₁₂OS
• Molecular Weight: 228.315
• DSSTox Substance ID: DTXSID401250088
• Mol file: 77869-10-4.mol

Synonyms:3-(3-methylthiophen-2-yl)-1-phenylprop-2-en-1-one;DTXSID401250088;3-(3-Methyl-2-thienyl)-1-phenyl-2-propen-1-one

Chemical Property of 3-(3-Methylthiophen-2-yl)-1-phenylprop-2-en-1-one

Chemical Property:

• XLogP3: 3.8
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 3
• Exact Mass: 228.06088618
• Heavy Atom Count: 16
• Complexity: 266

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

Useful:

• Canonical SMILES: CC1=C(SC=C1)C=CC(=O)C2=CC=CC=C2

Technology Process of 3-(3-Methylthiophen-2-yl)-1-phenylprop-2-en-1-one

There total 1 articles about 3-(3-Methylthiophen-2-yl)-1-phenylprop-2-en-1-one 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: 76.0%

3-methyl-2-thiophenecarboxaldehdye (5834-16-2,699531-50-5) + acetophenone (98-86-2) → 3-(3-methylthiophen-2-yl)-1-phenylprop-2-en-1-one (77869-10-4)

Guidance literature:

With potassium hydroxide; In methanol; at 20 ℃;

DOI:10.1007/s11164-018-3501-2

Reference yield: 72.0%

semicarbazide hydrochloride (563-41-7) + 3-(3-methylthiophen-2-yl)-1-phenylprop-2-en-1-one (77869-10-4) → 5-(3-methylthiophen-2-yl)-3-phenyl-4,5-dihydro-1H-pyrazole-1-carboxamide

Guidance literature:

With Amberlyst-15; In acetonitrile; at 20 ℃; Reagent/catalyst; Temperature;

DOI:10.1016/j.bioorg.2018.06.023

Reference yield: 70.0%

2,2,2-trifluoroethyl 2-[(1,3-dithian)-2-yl]-ethanthioate + 3-(3-methylthiophen-2-yl)-1-phenylprop-2-en-1-one (77869-10-4) → 11-(3-methylthiophen-2-yl)-9-phenyl-8-oxa-1,5-dithiaspiro[5.5]undec-9-en-7-one

Guidance literature:

With N-benzyl-N,N,N-triethylammonium chloride; potassium hydroxide; In acetonitrile; at 20 ℃; for 5h;

DOI:10.1016/j.tet.2014.09.022

upstream raw materials:

3-methyl-2-thiophenecarboxaldehdye

acetophenone

Downstream raw materials:

3-(3-methyl-2-thienyl)-1-phenyl-2,3-ditosyloxypropanone