Methyl (3-oxo-5-phenyl-2(3H)-furanylidene)acetate

Base Information

• Chemical Name: Methyl (3-oxo-5-phenyl-2(3H)-furanylidene)acetate
• CAS No.: 97180-95-5
• Molecular Formula: C13H10O4
• Molecular Weight: 230.2161
• NSC Number: 674912
• ChEMBL ID: CHEMBL1964650

Synonyms:Methyl (3-oxo-5-phenyl-2(3H)-furanylidene)acetate;97180-95-5;methyl (2E)-2-(3-oxo-5-phenylfuran-2-ylidene)acetate;Acetic acid, (3-oxo-5-phenyl-2(3H)-furanylidene)-, methyl ester;NSC674912;CHEMBL1964650;HMS1530P03;CCG-251212;NSC-674912;NCGC00175777-01;methyl 3-oxo-5-phenylfuran-2(3h)-ylideneacetate

Chemical Property of Methyl (3-oxo-5-phenyl-2(3H)-furanylidene)acetate

Chemical Property:

• Vapor Pressure: 1.49E-07mmHg at 25°C
• Boiling Point: 428.6°Cat760mmHg
• Flash Point: 194.5°C
• Density: 1.362g/cm³
• XLogP3: 1.8
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 3
• Exact Mass: 230.05790880
• Heavy Atom Count: 17
• Complexity: 386

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: COC(=O)C=C1C(=O)C=C(O1)C2=CC=CC=C2
• Isomeric SMILES: COC(=O)/C=C/1\C(=O)C=C(O1)C2=CC=CC=C2

Technology Process of Methyl (3-oxo-5-phenyl-2(3H)-furanylidene)acetate

There total 1 articles about Methyl (3-oxo-5-phenyl-2(3H)-furanylidene)acetate 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: 91.0%

methyl (triphenylphosphoranylidene)acetate (21204-67-1,2605-67-6) + 5-phenylfuran-2,3-dione (55991-67-8) → 5-Phenyl-2-(methoxycarbonylmethylene)-2,3-dihydrofuran-3-one (97180-95-5)

Guidance literature:

In chloroform; for 0.25h; Heating;

Reference yield: 96.0%

5-Phenyl-2-(methoxycarbonylmethylene)-2,3-dihydrofuran-3-one (97180-95-5) → 4,10-Dioxo-2,8-diphenyl-1,7-dioxa-dispiro[4.0.4.2]dodeca-2,8-diene-11,12-dicarboxylic acid dimethyl ester

Guidance literature:

Irradiation;

Reference yield: 92.0%

5-Phenyl-2-(methoxycarbonylmethylene)-2,3-dihydrofuran-3-one (97180-95-5) → Bromo-(2-bromo-3-oxo-5-phenyl-2,3-dihydro-furan-2-yl)-acetic acid methyl ester (139266-53-8)

Guidance literature:

With bromine; In tetrachloromethane; Ambient temperature;

DOI:10.1007/BF00778981

upstream raw materials:

methyl (triphenylphosphoranylidene)acetate

5-phenylfuran-2,3-dione

Downstream raw materials:

2-(benzylidenehydrazino)methoxycarbonylmethyl-5-phenyl-2,3-dihydro-3-furanone

methyl 6-phenyl-6-diphenylmethylenehydrazino-3,4-dioxo-5-hexenoate 3-diphenylmethylenehydrazone

{N'-[1-(4-Nitro-phenyl)-meth-(Z)-ylidene]-hydrazino}-(3-oxo-5-phenyl-2,3-dihydro-furan-2-yl)-acetic acid methyl ester

methyl 3-(3-phenyl-5-isoxazolyl)-3-oxopropionate oxime

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