(2Z)-3-(2H-1,3-benzodioxol-5-yl)-1-(4-fluorophenyl)prop-2-en-1-one

Base Information

Chemical Name:(2Z)-3-(2H-1,3-benzodioxol-5-yl)-1-(4-fluorophenyl)prop-2-en-1-one
CAS No.:7397-23-1
Molecular Formula:C16H11 F O3
Molecular Weight:270.26
Hs Code.:2932999099
European Community (EC) Number:653-935-7
ChEMBL ID:CHEMBL1401627
Mol file:7397-23-1.mol

Synonyms:(2Z)-3-(2H-1,3-benzodioxol-5-yl)-1-(4-fluorophenyl)prop-2-en-1-one;7397-23-1;CHEMBL1401627;MFCD00022993;NCGC00017796-01

Suppliers and Price of (2Z)-3-(2H-1,3-benzodioxol-5-yl)-1-(4-fluorophenyl)prop-2-en-1-one

Supply Marketing:

Business phase:: The product has achieved commercial mass production^*data from LookChem market partment

Manufacturers and distributors:

Manufacture/Brand
Chemicals and raw materials
Packaging
price

Sigma-Aldrich
4'-FLUORO-3,4-(METHYLENEDIOXY)CHALCONE Aldrich
250mg
$ 144.00

American Custom Chemicals Corporation
3-(1,3-BENZODIOXOL-5-YL)-1-(4-FLUOROPHENYL)PROP-2-EN-1-ONE 95.00%
250MG
$ 727.65

Total 8 raw suppliers

Chemical Property of (2Z)-3-(2H-1,3-benzodioxol-5-yl)-1-(4-fluorophenyl)prop-2-en-1-one

Chemical Property:

Vapor Pressure:2.78E-07mmHg at 25°C
Boiling Point:420.6°C at 760 mmHg
Flash Point:200.9°C
PSA：35.53000
Density:1.316g/cm³
LogP:3.45050
XLogP3:4
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:3
Exact Mass:270.06922237
Heavy Atom Count:20
Complexity:374

Purity/Quality:

NLT 98% ^*data from raw suppliers

4'-FLUORO-3,4-(METHYLENEDIOXY)CHALCONE Aldrich ^*data from reagent suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:C1OC2=C(O1)C=C(C=C2)C=CC(=O)C3=CC=C(C=C3)F
Isomeric SMILES:C1OC2=C(O1)C=C(C=C2)/C=C\C(=O)C3=CC=C(C=C3)F

Technology Process of (2Z)-3-(2H-1,3-benzodioxol-5-yl)-1-(4-fluorophenyl)prop-2-en-1-one

There total 6 articles about (2Z)-3-(2H-1,3-benzodioxol-5-yl)-1-(4-fluorophenyl)prop-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:

: 120-57-0,30024-74-9
piperonal

: 403-42-9
1-(4-fluorophenyl)ethanone

: 7397-23-1
3-benzo[1,3]dioxol-5-yl-1-(4-fluoro-phenyl)-propenone

Guidance literature:: With sodium hydroxide; In ethanol; Reflux;
DOI:10.1002/ardp.201100170

Reference yield:

: 139-85-5
3,4-dihydroxybenzaldehyde

: 7397-23-1
3-benzo[1,3]dioxol-5-yl-1-(4-fluoro-phenyl)-propenone

Guidance literature:: Multi-step reaction with 2 steps

1: potassium carbonate / acetonitrile / 24 h / Reflux

2: potassium hydroxide / ethanol; water / 20 °C

With potassium carbonate; potassium hydroxide; In ethanol; water; acetonitrile;
DOI:10.1016/j.bmc.2012.11.020

Reference yield:

: 29668-44-8
2,3-dihydro-benzo[1,4]dioxin-6-carbaldehyde

: 7397-23-1
3-benzo[1,3]dioxol-5-yl-1-(4-fluoro-phenyl)-propenone

Guidance literature:: Multi-step reaction with 4 steps

1: potassium hydroxide / ethanol; water / 20 °C

2: potassium hydroxide / ethanol / 12 h / Reflux

3: potassium carbonate / ethanol / 8 h / 80 °C

4: potassium hydroxide / ethanol; water / 20 °C

With potassium carbonate; potassium hydroxide; In ethanol; water;
DOI:10.1016/j.bmc.2012.11.020